NP-MRD: Showing NP-Card for Beta-amanitin (NP0350823)

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Record Information

Version

2.0

Created at

2025-03-11 18:45:34 UTC

Updated at

2025-10-22 19:37:40 UTC

NP-MRD ID

NP0350823

Natural Product DOI

https://doi.org/10.57994/3807

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Beta-amanitin

Description

Beta-amanitin belongs to the class of organic compounds known as cyclic peptides. Cyclic peptides are compounds containing a cyclic moiety bearing a peptide backbone. Beta-amanitin was first documented in 2022 (PMID: 36496736). Based on a literature review a significant number of articles have been published on Beta-amanitin (PMID: 37929913) (PMID: 36633081) (PMID: 39301580) (PMID: 39260920) (PMID: 38971475) (PMID: 38810334).

Structure

MOL SDF PDB SMILES InChI


  Mrv2104 06082318522D          

 64 68  0  0  1  0            999 V2000
    5.7084   -1.5427    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7906   -1.8732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9223   -2.7368    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3918   -3.3503    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
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    5.1934   -5.7927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0678   -4.6976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1813   -4.9740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
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 30 64  1  0  0  0  0
M  RAD  2  38   2  39   2
M  END


  Mrv2104 06082318522D          

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M  RAD  2  38   2  39   2
M  END
> <DATABASE_ID>
NP0350823

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC[C@H](C)[C@@H]1NC(=O)CNC(=O)[C@@H]2CC3=C(NC4=C3C=CC(O)=C4)[S]([O])C[C@H](NC(=O)CNC1=O)C(=O)N[C@@H](CC(O)=O)C(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@@H]([C@@H](C)[C@@H](O)CO)C(=O)N2

> <INCHI_IDENTIFIER>
InChI=1S/C39H53N9O15S/c1-4-16(2)31-36(60)41-11-28(53)42-25-15-64(63)38-21(20-6-5-18(50)7-22(20)45-38)9-23(33(57)40-12-29(54)46-31)43-37(61)32(17(3)27(52)14-49)47-35(59)26-8-19(51)13-48(26)39(62)24(10-30(55)56)44-34(25)58/h5-7,16-17,19,23-27,31-32,45,49-52H,4,8-15H2,1-3H3,(H,40,57)(H,41,60)(H,42,53)(H,43,61)(H,44,58)(H,46,54)(H,47,59)(H,55,56)/t16-,17-,19+,23-,24-,25-,26-,27-,31?,32-,64?/m0/s1

> <INCHI_KEY>
IEQCUEXVAPAFMQ-UMVUCPTLSA-N

> <FORMULA>
C39H53N9O15S

> <MOLECULAR_WEIGHT>
919.96

> <EXACT_MASS>
919.338183217

> <JCHEM_ACCEPTOR_COUNT>
15

> <JCHEM_ATOM_COUNT>
117

> <JCHEM_AVERAGE_POLARIZABILITY>
88.40771593016173

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
13

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_LOGP>
-6.727011688999998

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
5

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
9.387812730165663

> <JCHEM_PKA_STRONGEST_ACIDIC>
3.6497096497428925

> <JCHEM_PKA_STRONGEST_BASIC>
-5.529626410854329

> <JCHEM_POLAR_SURFACE_AREA>
358.02

> <JCHEM_REFRACTIVITY>
219.4847000000002

> <JCHEM_ROTATABLE_BOND_COUNT>
7

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 08-JUN-23   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   08-JUN-23         0                                  
HETATM    1  O   UNK     0      10.656  -2.880   0.000  0.00  0.00           O+0
HETATM    2  C   UNK     0       8.942  -3.497   0.000  0.00  0.00           C+0
HETATM    3  N   UNK     0       9.188  -5.109   0.000  0.00  0.00           N+0
HETATM    4  C   UNK     0       8.198  -6.254   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       8.702  -7.929   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       9.798  -9.177   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       9.694 -10.813   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0      10.723 -12.016   0.000  0.00  0.00           O+0
HETATM    9  O   UNK     0      11.327  -8.769   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0       7.805  -9.285   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       6.459  -5.670   0.000  0.00  0.00           C+0
HETATM   12  N   UNK     0       6.135  -3.882   0.000  0.00  0.00           N+0
HETATM   13  C   UNK     0       7.645  -3.293   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       6.824  -4.639   0.000  0.00  0.00           C+0
HETATM   15  N   UNK     0       5.128  -4.912   0.000  0.00  0.00           N+0
HETATM   16  C   UNK     0       3.589  -4.524   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0       7.021  -6.484   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0       9.062  -2.151   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       9.536  -0.594   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       8.882   0.800   0.000  0.00  0.00           C+0
HETATM   21  N   UNK     0      10.123   2.272   0.000  0.00  0.00           N+0
HETATM   22  C   UNK     0      11.354   1.110   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      11.064  -0.403   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      12.228  -1.410   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      13.683  -0.906   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      13.974   0.607   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0      15.598   0.714   0.000  0.00  0.00           O+0
HETATM   28  C   UNK     0      12.750   1.405   0.000  0.00  0.00           C+0
HETATM   29  O   UNK     0       5.405  -7.013   0.000  0.00  0.00           O+0
HETATM   30  C   UNK     0       7.856  -2.088   0.000  0.00  0.00           C+0
HETATM   31  N   UNK     0       7.095  -0.749   0.000  0.00  0.00           N+0
HETATM   32  C   UNK     0       7.616   0.792   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0       8.639   2.250   0.000  0.00  0.00           C+0
HETATM   34  N   UNK     0       8.810   3.860   0.000  0.00  0.00           N+0
HETATM   35  C   UNK     0       7.684   4.985   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0       6.137   4.667   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0       6.254   3.072   0.000  0.00  0.00           C+0
HETATM   38  S   UNK     0       7.404   1.951   0.000  0.00  0.00           S+0
HETATM   39  O   UNK     0       6.445   0.533   0.000  0.00  0.00           O+0
HETATM   40  N   UNK     0       4.665   5.243   0.000  0.00  0.00           N+0
HETATM   41  C   UNK     0       3.151   4.845   0.000  0.00  0.00           C+0
HETATM   42  C   UNK     0       2.246   3.572   0.000  0.00  0.00           C+0
HETATM   43  N   UNK     0       1.505   2.206   0.000  0.00  0.00           N+0
HETATM   44  C   UNK     0       1.821   0.702   0.000  0.00  0.00           C+0
HETATM   45  C   UNK     0       2.907  -0.382   0.000  0.00  0.00           C+0
HETATM   46  C   UNK     0       1.067  -0.338   0.000  0.00  0.00           C+0
HETATM   47  C   UNK     0      -0.480  -1.279   0.000  0.00  0.00           C+0
HETATM   48  C   UNK     0      -2.116  -1.406   0.000  0.00  0.00           C+0
HETATM   49  C   UNK     0       0.235   1.283   0.000  0.00  0.00           C+0
HETATM   50  N   UNK     0       2.607  -1.902   0.000  0.00  0.00           N+0
HETATM   51  C   UNK     0       2.446  -3.456   0.000  0.00  0.00           C+0
HETATM   52  O   UNK     0       1.125  -4.479   0.000  0.00  0.00           O+0
HETATM   53  O   UNK     0       0.083   0.246   0.000  0.00  0.00           O+0
HETATM   54  O   UNK     0       2.494   6.327   0.000  0.00  0.00           O+0
HETATM   55  O   UNK     0       7.763   6.598   0.000  0.00  0.00           O+0
HETATM   56  C   UNK     0      10.494   1.648   0.000  0.00  0.00           C+0
HETATM   57  C   UNK     0      11.919   2.744   0.000  0.00  0.00           C+0
HETATM   58  O   UNK     0      12.126   4.414   0.000  0.00  0.00           O+0
HETATM   59  O   UNK     0      13.733   2.460   0.000  0.00  0.00           O+0
HETATM   60  O   UNK     0       6.055   1.643   0.000  0.00  0.00           O+0
HETATM   61  C   UNK     0       5.587  -1.059   0.000  0.00  0.00           C+0
HETATM   62  C   UNK     0       5.415  -2.589   0.000  0.00  0.00           C+0
HETATM   63  O   UNK     0       3.711  -2.589   0.000  0.00  0.00           O+0
HETATM   64  C   UNK     0       6.817  -3.225   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3   30                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5   11                                                  
CONECT    5    4    6   10                                                  
CONECT    6    5    7    9                                                  
CONECT    7    6    8                                                       
CONECT    8    7                                                            
CONECT    9    6                                                            
CONECT   10    5                                                            
CONECT   11    4   12   29                                                  
CONECT   12   11   13                                                       
CONECT   13   12   14   18                                                  
CONECT   14   13   15   17                                                  
CONECT   15   14   16                                                       
CONECT   16   15   51                                                       
CONECT   17   14                                                            
CONECT   18   13   19                                                       
CONECT   19   18   20   23                                                  
CONECT   20   19   21   38                                                  
CONECT   21   20   22                                                       
CONECT   22   21   23   28                                                  
CONECT   23   22   19   24                                                  
CONECT   24   23   25                                                       
CONECT   25   24   26                                                       
CONECT   26   25   27   28                                                  
CONECT   27   26                                                            
CONECT   28   26   22                                                       
CONECT   29   11                                                            
CONECT   30    2   31   64                                                  
CONECT   31   30   32   61                                                  
CONECT   32   31   33   60                                                  
CONECT   33   32   34   56                                                  
CONECT   34   33   35                                                       
CONECT   35   34   36   55                                                  
CONECT   36   35   37   40                                                  
CONECT   37   36   38                                                       
CONECT   38   37   20   39                                                  
CONECT   39   38                                                            
CONECT   40   36   41                                                       
CONECT   41   40   42   54                                                  
CONECT   42   41   43                                                       
CONECT   43   42   44                                                       
CONECT   44   43   45   53                                                  
CONECT   45   44   46   50                                                  
CONECT   46   45   47   49                                                  
CONECT   47   46   48                                                       
CONECT   48   47                                                            
CONECT   49   46                                                            
CONECT   50   45   51                                                       
CONECT   51   50   16   52                                                  
CONECT   52   51                                                            
CONECT   53   44                                                            
CONECT   54   41                                                            
CONECT   55   35                                                            
CONECT   56   33   57                                                       
CONECT   57   56   58   59                                                  
CONECT   58   57                                                            
CONECT   59   57                                                            
CONECT   60   32                                                            
CONECT   61   31   62                                                       
CONECT   62   61   63   64                                                  
CONECT   63   62                                                            
CONECT   64   62   30                                                       
MASTER        0    0    0    0    0    0    0    0   64    0  136    0
END

View in JSmol

Synonyms

Value	Source
b-Amanitin	Generator
Β-amanitin	Generator

Chemical Formula

C₃₉H₅₃N₉O₁₅S

Average Mass

919.9600 Da

Monoisotopic Mass

919.33818 Da

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

CC[C@H](C)[C@@H]1NC(=O)CNC(=O)[C@@H]2CC3=C(NC4=C3C=CC(O)=C4)[S]([O])C[C@H](NC(=O)CNC1=O)C(=O)N[C@@H](CC(O)=O)C(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@@H]([C@@H](C)[C@@H](O)CO)C(=O)N2

InChI Identifier

InChI=1S/C39H53N9O15S/c1-4-16(2)31-36(60)41-11-28(53)42-25-15-64(63)38-21(20-6-5-18(50)7-22(20)45-38)9-23(33(57)40-12-29(54)46-31)43-37(61)32(17(3)27(52)14-49)47-35(59)26-8-19(51)13-48(26)39(62)24(10-30(55)56)44-34(25)58/h5-7,16-17,19,23-27,31-32,45,49-52H,4,8-15H2,1-3H3,(H,40,57)(H,41,60)(H,42,53)(H,43,61)(H,44,58)(H,46,54)(H,47,59)(H,55,56)/t16-,17-,19+,23-,24-,25-,26-,27-,31?,32-,64?/m0/s1

InChI Key

IEQCUEXVAPAFMQ-UMVUCPTLSA-N

Experimental Spectra

Spectrum Type	Description	Depositor Email	Depositor Organization	Depositor	Deposition Date	View
ROESY NMR	[¹H, ¹H] NMR Spectrum (2D, 699 MHz, C2D6OS, experimental)	adrien.jagora@universite-paris-saclay.fr	Université Paris-Saclay	Adrien Jagora	2025-03-11	View Spectrum
HMBC NMR	[¹H, ¹³C] NMR Spectrum (2D, 699 MHz, C2D6OS, experimental)	adrien.jagora@universite-paris-saclay.fr	Université Paris-Saclay	Adrien Jagora	2025-03-11	View Spectrum
HSQC NMR	[¹H, ¹³C] NMR Spectrum (2D, 699 MHz, C2D6OS, experimental)	adrien.jagora@universite-paris-saclay.fr	Université Paris-Saclay	Adrien Jagora	2025-03-11	View Spectrum
COSY NMR	[¹H, ¹H] NMR Spectrum (2D, 699 MHz, C2D6OS, experimental)	adrien.jagora@universite-paris-saclay.fr	Université Paris-Saclay	Adrien Jagora	2025-03-11	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 176 MHz, C2D6OS, experimental)	adrien.jagora@universite-paris-saclay.fr	Université Paris-Saclay	Adrien Jagora	2025-03-11	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 699 MHz, C2D6OS, experimental)	adrien.jagora@universite-paris-saclay.fr	Université Paris-Saclay	Adrien Jagora	2025-03-11	View Spectrum

Predicted Spectra

Spectrum Type	Description	Depositor ID	Depositor Organization	Depositor	Deposition Date	View

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Amanita phalloides		Not Available

Chemical Taxonomy

Description

This compound belongs to the class of organic compounds known as cyclic peptides. These are compounds containing a cyclic moiety bearing a peptide backbone.

Kingdom

Organic compounds

Super Class

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Sub Class

Amino acids, peptides, and analogues

Direct Parent

Cyclic peptides

Alternative Parents

Substituents

Cyclic alpha peptide
Aspartic acid or derivatives
Alpha-amino acid amide
Alpha-amino acid or derivatives
Indole or derivatives
Indole
N-acylpyrrolidine
1-hydroxy-2-unsubstituted benzenoid
Benzenoid
Substituted pyrrole
N-acyl-amine
Heteroaromatic compound
Cyclic carboximidic acid
Tertiary carboxylic acid amide
Pyrrolidine
Pyrrole
Amino acid
Sulfoxide
Secondary alcohol
Lactam
Carboxamide group
Amino acid or derivatives
Azacycle
Organoheterocyclic compound
Organic 1,3-dipolar compound
Propargyl-type 1,3-dipolar organic compound
Secondary amine
Monocarboxylic acid or derivatives
Secondary aliphatic amine
Carboxylic acid
Carboximidic acid
Organic nitrogen compound
Organic oxygen compound
Organopnictogen compound
Organic oxide
Hydrocarbon derivative
Organosulfur compound
Organooxygen compound
Organonitrogen compound
Amine
Alcohol
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

Not Available

Physical Properties

State

Not Available

Experimental Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	Not Available	Not Available

Predicted Properties

Property	Value	Source
logP	-6.7	ChemAxon
pKa (Strongest Acidic)	3.65	ChemAxon
pKa (Strongest Basic)	-5.5	ChemAxon
Physiological Charge	-1	ChemAxon
Hydrogen Acceptor Count	15	ChemAxon
Hydrogen Donor Count	13	ChemAxon
Polar Surface Area	358.02 Å²	ChemAxon
Rotatable Bond Count	7	ChemAxon
Refractivity	219.48 m³·mol⁻¹	ChemAxon
Polarizability	88.41 Å³	ChemAxon
Number of Rings	5	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	ChemAxon

External Links

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

Not Available

KNApSAcK ID

Not Available

Chemspider ID

Not Available

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Β-Amanitin

METLIN ID

Not Available

PubChem Compound

146510104

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Yang S, Wen D, Zheng F, Pu S, Chen Z, Chen M, Di B, Liu W, Shi Y: Simple and rapid detection of three amatoxins and three phallotoxins in human body fluids by UPLC-MS-MS and its application in 15 poisoning cases. J Anal Toxicol. 2024 Jan 31;48(1):44-53. doi: 10.1093/jat/bkad081. [PubMed:37929913 ]
He L, Tang X, Zhao J, Yang Q, Li L: [Determination of five amanita peptide toxins in poisonous mushrooms by ultra performance liquid chromatography-quadrupole electrostatic field orbitrap high resolution mass spectrometry]. Se Pu. 2023 Jan;41(1):94-103. doi: 10.3724/SP.J.1123.2022.03010. [PubMed:36633081 ]
Cao M, Luo S, Kang T, Ou S: An outbreak of Galerina sulciceps-like (Galerina cf. sulciceps) mushroom poisoning. Clin Toxicol (Phila). 2024 Nov;62(11):707-713. doi: 10.1080/15563650.2024.2402501. Epub 2024 Sep 20. [PubMed:39301580 ]
Yang R, Zhao C, Ding S, Ruan J, Li D, Xiang Y, Zhou J, Su H, Li N: Label-free SELEX of aptamers for ultra-sensitive electrochemical aptasensor detection of amanitin in wild mushrooms. Anal Chim Acta. 2024 Oct 16;1326:343136. doi: 10.1016/j.aca.2024.343136. Epub 2024 Aug 20. [PubMed:39260920 ]
Yang S, Wang X, Zheng F, Pei L, Liu J, Di B, Shi Y: Toxicokinetics of alpha- and beta-amanitin in mice following single and combined administrations: Simulating in vivo amatoxins processes in clinical cases. Toxicon. 2024 Aug 28;247:107839. doi: 10.1016/j.toxicon.2024.107839. Epub 2024 Jul 4. [PubMed:38971475 ]
Leite M, Freitas A, Mitchell T, Barbosa J, Ramos F: Amanitin determination in bile samples by UHPLC-MS: LR-MS and HR-MS analytical performance. J Pharm Biomed Anal. 2024 Sep 1;247:116253. doi: 10.1016/j.jpba.2024.116253. Epub 2024 May 24. [PubMed:38810334 ]
He Z, Li X, Feng M, Wang X, Wang Y, Chen J: Wild mushroom poisoning: A case study of amatoxin-containing mushrooms and implications for public health. Toxicon. 2024 Mar;240:107639. doi: 10.1016/j.toxicon.2024.107639. Epub 2024 Feb 3. [PubMed:38311256 ]
Hof WFJ, Visser M, de Jong JJ, Rajasekar MN, Schuringa JJ, de Graaf IAM, Touw DJ, Dekkers BGJ: Unraveling Hematotoxicity of alpha-Amanitin in Cultured Hematopoietic Cells. Toxins (Basel). 2024 Jan 22;16(1):61. doi: 10.3390/toxins16010061. [PubMed:38276537 ]
Zhong J, Xu P, Li H, Sun C, Tong Y, Yao Q, Yu C: Acute hepatic and kidney injury after ingestion of Lepiota brunneoincarnata: Report of 2 cases. Toxicon. 2024 Feb 23;239:107605. doi: 10.1016/j.toxicon.2024.107605. Epub 2024 Jan 4. [PubMed:38184282 ]
Liu LQ, Chen JZ, Fu WS, Tang CY: [Determination of amanita peptide and tryptamine toxins in wild mushrooms by high performance liquid chromatography-tandem mass spectrometry]. Se Pu. 2023 Nov;41(11):976-985. doi: 10.3724/SP.J.1123.2023.07013. [PubMed:37968816 ]
Barbosa I, Domingues C, Ramos F, Barbosa RM: Analytical methods for amatoxins: A comprehensive review. J Pharm Biomed Anal. 2023 Aug 5;232:115421. doi: 10.1016/j.jpba.2023.115421. Epub 2023 Apr 28. [PubMed:37146495 ]
Nagayama T, Kamijo Y, Fukiharu T, Nguyen NH, Imai K, Takahashi I: Amatoxin poisoning caused by Galerina sulciceps, a species with no prior record of identification in Japan: a case report. Toxicon. 2023 Jun 15;229:107139. doi: 10.1016/j.toxicon.2023.107139. Epub 2023 Apr 28. [PubMed:37119858 ]
Barbosa I, Domingues C, Barbosa RM, Ramos F: Amanitins in Wild Mushrooms: The Development of HPLC-UV-EC and HPLC-DAD-MS Methods for Food Safety Purposes. Foods. 2022 Dec 5;11(23):3929. doi: 10.3390/foods11233929. [PubMed:36496736 ]
Mao Z, Yu Y, Sun H, Cao Y, Jiang Q, Chu C, Sun Y, Huang S, Zhang J, Chen F: Rapid detection of alpha-amanitin and beta-amanitin in rat plasma by ultra-performance liquid chromatography-tandem mass spectrometry and its application to the toxicokinetic study of Lepiota brunneoincarnata. Forensic Toxicol. 2022 Jan;40(1):111-118. doi: 10.1007/s11419-021-00607-5. Epub 2021 Dec 1. [PubMed:36454499 ]
Zhou S, Guo L, Xu X, Song S, Liu L, Kuang H, Zhu Y, Xu L, Xu C: Ultrasensitive paper sensor for simultaneous detection of alpha-amanitin and beta-amanitin by the production of monoclonal antibodies. Food Chem. 2022 Dec 1;396:133660. doi: 10.1016/j.foodchem.2022.133660. Epub 2022 Jul 9. [PubMed:35839720 ]
Zhang X, Cai X, Zhang X, Li R, Zhao Y: [Highly sensitive determination of three kinds of amanitins in urine and plasma by ultra performance liquid chromatography-triple quadrupole mass spectrometry coupled with immunoaffinity column clean-up]. Se Pu. 2022 May 8;40(5):443-451. doi: 10.3724/SP.J.1123.2021.08018. [PubMed:35478003 ]
Bang YY, Song IS, Lee MS, Lim CH, Cho YY, Lee JY, Kang HC, Lee HS: Toxicokinetics of beta-Amanitin in Mice and In Vitro Drug-Drug Interaction Potential. Pharmaceutics. 2022 Apr 1;14(4):774. doi: 10.3390/pharmaceutics14040774. [PubMed:35456608 ]
Bayram R, Yilmaz I, Yaykasli KO, Kaya E: Erdosteine reduces cytotoxicity induced by alpha- and beta-amanitin, but not gamma-amanitin, in CA3 hepatocyte cultures. Toxicon. 2022 Jul 15;213:52-58. doi: 10.1016/j.toxicon.2022.04.009. Epub 2022 Apr 17. [PubMed:35443191 ]
Sarawi S, Shi YN, Lotz-Winter H, Reschke K, Bode HB, Piepenbring M: Occurrence and chemotaxonomical analysis of amatoxins in Lepiota spp. (Agaricales). Phytochemistry. 2022 Mar;195:113069. doi: 10.1016/j.phytochem.2021.113069. Epub 2021 Dec 26. [PubMed:34965486 ]
DOI: 10.1021/acs.jnatprod.5c00820
PMID: 41077760

Showing NP-Card for Beta-amanitin (NP0350823)

MOL for NP0350823 (Beta-amanitin)

3D MOL for NP0350823 (Beta-amanitin)

3D SDF for NP0350823 (Beta-amanitin)

3D-SDF for NP0350823 (Beta-amanitin)

PDB for NP0350823 (Beta-amanitin)

3D PDB for NP0350823 (Beta-amanitin)

SMILES for NP0350823 (Beta-amanitin)

INCHI for NP0350823 (Beta-amanitin)

Structure for NP0350823 (Beta-amanitin)

3D Structure for NP0350823 (Beta-amanitin)