NP-MRD: Showing NP-Card for Asperustin E (NP0332890)

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Record Information

Version

2.0

Created at

2024-05-01 21:23:27 UTC

Updated at

2024-09-03 04:20:36 UTC

NP-MRD ID

NP0332890

Natural Product DOI

https://doi.org/10.57994/2170

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Asperustin E

Description

Asperustin E belongs to the class of organic compounds known as 4-prenylated xanthones. These are organic compounds containing a C5-isoprenoid group linked to a xanthone moiety at the 4-position. Xanthone is a tricyclic compound made up of two benzene rings linearly fused to each other through a pyran ring that carries a ketone group. Asperustin E was first documented in 2024 (PMID: 38441877). Based on a literature review very few articles have been published on Asperustin E.

Structure

MOL SDF PDB SMILES InChI


  Mrv2104 01142300002D          

 33 37  0  0  1  0            999 V2000
    3.7759   -3.5114    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6680   -2.6935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9057   -2.3780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7978   -1.5601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0355   -1.2446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9276   -0.4267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1653   -0.1112    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0574    0.7067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9495    1.5246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2395    0.5988    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8753    0.8146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3811   -1.7470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4890   -2.5649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2513   -2.8804    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3592   -3.6983    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4522   -1.0577    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2145   -1.3732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8688   -0.8708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6311   -1.1863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7390   -2.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5503   -2.1543    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.1183   -2.7526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8629   -2.3972    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.5880   -2.7906    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2913   -2.3594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7549   -1.5793    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1568   -2.8794    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9437   -1.4292    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.3372   -0.7040    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3757   -0.8309    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0847   -2.5066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1926   -3.3245    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3224   -2.1911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 11  1  0  0  0  0
  5 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
  3 14  1  0  0  0  0
 14 15  1  0  0  0  0
  4 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 21 20  1  0  0  0  0
 21 22  1  0  0  0  0
 23 22  1  0  0  0  0
 23 24  1  1  0  0  0
 24 25  1  0  0  0  0
 23 26  1  0  0  0  0
 21 27  1  6  0  0  0
 21 28  1  0  0  0  0
 28 26  1  0  0  0  0
 28 29  1  6  0  0  0
 28 30  1  0  0  0  0
 19 30  1  0  0  0  0
 20 31  1  0  0  0  0
 31 32  1  0  0  0  0
 31 33  2  0  0  0  0
 17 33  1  0  0  0  0
  2 33  1  0  0  0  0
M  END


  Mrv2104 01142300002D          

 33 37  0  0  1  0            999 V2000
    3.7759   -3.5114    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6680   -2.6935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9057   -2.3780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7978   -1.5601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0355   -1.2446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9276   -0.4267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1653   -0.1112    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0574    0.7067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9495    1.5246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2395    0.5988    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8753    0.8146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3811   -1.7470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4890   -2.5649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2513   -2.8804    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3592   -3.6983    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4522   -1.0577    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2145   -1.3732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8688   -0.8708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6311   -1.1863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7390   -2.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5503   -2.1543    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.1183   -2.7526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8629   -2.3972    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.5880   -2.7906    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2913   -2.3594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7549   -1.5793    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1568   -2.8794    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9437   -1.4292    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.3372   -0.7040    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3757   -0.8309    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0847   -2.5066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1926   -3.3245    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3224   -2.1911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 11  1  0  0  0  0
  5 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
  3 14  1  0  0  0  0
 14 15  1  0  0  0  0
  4 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 21 20  1  0  0  0  0
 21 22  1  0  0  0  0
 23 22  1  0  0  0  0
 23 24  1  1  0  0  0
 24 25  1  0  0  0  0
 23 26  1  0  0  0  0
 21 27  1  6  0  0  0
 21 28  1  0  0  0  0
 28 26  1  0  0  0  0
 28 29  1  6  0  0  0
 28 30  1  0  0  0  0
 19 30  1  0  0  0  0
 20 31  1  0  0  0  0
 31 32  1  0  0  0  0
 31 33  2  0  0  0  0
 17 33  1  0  0  0  0
  2 33  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0332890

> <DATABASE_NAME>
NP-MRD

> <SMILES>
[H][C@]12O[C@H](C[C@@]1([H])C1=C(O2)C=C2OC3=C(C(O)=CC=C3CCC(C)(C)O)C(=O)C2=C1O)OC

> <INCHI_IDENTIFIER>
InChI=1S/C23H24O8/c1-23(2,27)7-6-10-4-5-12(24)17-20(26)18-14(29-21(10)17)9-13-16(19(18)25)11-8-15(28-3)31-22(11)30-13/h4-5,9,11,15,22,24-25,27H,6-8H2,1-3H3/t11-,15+,22-/m0/s1

> <INCHI_KEY>
BUFPGQMRLSZYHK-LFENUTQHSA-N

> <FORMULA>
C23H24O8

> <MOLECULAR_WEIGHT>
428.437

> <EXACT_MASS>
428.147117733

> <JCHEM_ACCEPTOR_COUNT>
7

> <JCHEM_ATOM_COUNT>
55

> <JCHEM_AVERAGE_POLARIZABILITY>
43.85960831706663

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
3

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
(4S,6R,8S)-2,18-dihydroxy-15-(3-hydroxy-3-methylbutyl)-6-methoxy-7,9,13-trioxapentacyclo[10.8.0.0^{3,10}.0^{4,8}.0^{14,19}]icosa-1,3(10),11,14(19),15,17-hexaen-20-one

> <JCHEM_LOGP>
4.303951481666665

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
5

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
8.99024445343231

> <JCHEM_PKA_STRONGEST_ACIDIC>
8.299569658890368

> <JCHEM_PKA_STRONGEST_BASIC>
-2.6304051047369468

> <JCHEM_POLAR_SURFACE_AREA>
114.68000000000002

> <JCHEM_REFRACTIVITY>
110.24759999999999

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
(4S,6R,8S)-2,18-dihydroxy-15-(3-hydroxy-3-methylbutyl)-6-methoxy-7,9,13-trioxapentacyclo[10.8.0.0^{3,10}.0^{4,8}.0^{14,19}]icosa-1,3(10),11,14(19),15,17-hexaen-20-one

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 14-JAN-23   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   14-JAN-23         0                                  
HETATM    1  O   UNK     0       7.048  -6.555   0.000  0.00  0.00           O+0
HETATM    2  C   UNK     0       6.847  -5.028   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       5.424  -4.439   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       5.223  -2.912   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       3.800  -2.323   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       3.598  -0.796   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       2.175  -0.208   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       1.974   1.319   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       1.772   2.846   0.000  0.00  0.00           C+0
HETATM   10  O   UNK     0       0.447   1.118   0.000  0.00  0.00           O+0
HETATM   11  C   UNK     0       3.501   1.521   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       2.578  -3.261   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       2.780  -4.788   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       4.202  -5.377   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0       4.404  -6.904   0.000  0.00  0.00           O+0
HETATM   16  O   UNK     0       6.444  -1.974   0.000  0.00  0.00           O+0
HETATM   17  C   UNK     0       7.867  -2.563   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       9.088  -1.625   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      10.511  -2.214   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      10.713  -3.741   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      12.227  -4.021   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      13.288  -5.138   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      14.677  -4.475   0.000  0.00  0.00           C+0
HETATM   24  O   UNK     0      16.031  -5.209   0.000  0.00  0.00           O+0
HETATM   25  C   UNK     0      17.344  -4.404   0.000  0.00  0.00           C+0
HETATM   26  O   UNK     0      14.476  -2.948   0.000  0.00  0.00           O+0
HETATM   27  H   UNK     0      11.493  -5.375   0.000  0.00  0.00           H+0
HETATM   28  C   UNK     0      12.962  -2.668   0.000  0.00  0.00           C+0
HETATM   29  H   UNK     0      13.696  -1.314   0.000  0.00  0.00           H+0
HETATM   30  O   UNK     0      11.901  -1.551   0.000  0.00  0.00           O+0
HETATM   31  C   UNK     0       9.491  -4.679   0.000  0.00  0.00           C+0
HETATM   32  O   UNK     0       9.693  -6.206   0.000  0.00  0.00           O+0
HETATM   33  C   UNK     0       8.068  -4.090   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3   33                                                  
CONECT    3    2    4   14                                                  
CONECT    4    3    5   16                                                  
CONECT    5    4    6   12                                                  
CONECT    6    5    7                                                       
CONECT    7    6    8                                                       
CONECT    8    7    9   10   11                                             
CONECT    9    8                                                            
CONECT   10    8                                                            
CONECT   11    8                                                            
CONECT   12    5   13                                                       
CONECT   13   12   14                                                       
CONECT   14   13    3   15                                                  
CONECT   15   14                                                            
CONECT   16    4   17                                                       
CONECT   17   16   18   33                                                  
CONECT   18   17   19                                                       
CONECT   19   18   20   30                                                  
CONECT   20   19   21   31                                                  
CONECT   21   20   22   27   28                                             
CONECT   22   21   23                                                       
CONECT   23   22   24   26                                                  
CONECT   24   23   25                                                       
CONECT   25   24                                                            
CONECT   26   23   28                                                       
CONECT   27   21                                                            
CONECT   28   21   26   29   30                                             
CONECT   29   28                                                            
CONECT   30   28   19                                                       
CONECT   31   20   32   33                                                  
CONECT   32   31                                                            
CONECT   33   31   17    2                                                  
MASTER        0    0    0    0    0    0    0    0   33    0   74    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₂₃H₂₄O₈

Average Mass

428.4370 Da

Monoisotopic Mass

428.14712 Da

IUPAC Name

(4S,6R,8S)-2,18-dihydroxy-15-(3-hydroxy-3-methylbutyl)-6-methoxy-7,9,13-trioxapentacyclo[10.8.0.0^{3,10}.0^{4,8}.0^{14,19}]icosa-1,3(10),11,14(19),15,17-hexaen-20-one

Traditional Name

(4S,6R,8S)-2,18-dihydroxy-15-(3-hydroxy-3-methylbutyl)-6-methoxy-7,9,13-trioxapentacyclo[10.8.0.0^{3,10}.0^{4,8}.0^{14,19}]icosa-1,3(10),11,14(19),15,17-hexaen-20-one

CAS Registry Number

Not Available

SMILES

[H][C@]12O[C@H](C[C@@]1([H])C1=C(O2)C=C2OC3=C(C(O)=CC=C3CCC(C)(C)O)C(=O)C2=C1O)OC

InChI Identifier

InChI=1S/C23H24O8/c1-23(2,27)7-6-10-4-5-12(24)17-20(26)18-14(29-21(10)17)9-13-16(19(18)25)11-8-15(28-3)31-22(11)30-13/h4-5,9,11,15,22,24-25,27H,6-8H2,1-3H3/t11-,15+,22-/m0/s1

InChI Key

BUFPGQMRLSZYHK-LFENUTQHSA-N

Experimental Spectra

Spectrum Type	Description	Depositor Email	Depositor Organization	Depositor	Deposition Date	View
NOESY NMR	[¹H, ¹H] NMR Spectrum (2D, 400 MHz, CDCl3, experimental)	ruanhl@hust.edu.cn	Huazhong University of Science and Technology	Han-Li Ruan	2024-05-01	View Spectrum
HMBC NMR	[¹H, ¹³C] NMR Spectrum (2D, 400 MHz, CDCl3, experimental)	ruanhl@hust.edu.cn	Huazhong University of Science and Technology	Han-Li Ruan	2024-05-01	View Spectrum
HSQC NMR	[¹H, ¹³C] NMR Spectrum (2D, 400 MHz, CDCl3, experimental)	ruanhl@hust.edu.cn	Huazhong University of Science and Technology	Han-Li Ruan	2024-05-01	View Spectrum
COSY NMR	[¹H, ¹H] NMR Spectrum (2D, 400 MHz, CDCl3, experimental)	ruanhl@hust.edu.cn	Huazhong University of Science and Technology	Han-Li Ruan	2024-05-01	View Spectrum
1D_DEPT NMR	¹³C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)	ruanhl@hust.edu.cn	Huazhong University of Science and Technology	Han-Li Ruan	2024-05-01	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 400 MHz, CDCl3, experimental)	ruanhl@hust.edu.cn	Huazhong University of Science and Technology	Han-Li Ruan	2024-05-01	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)	ruanhl@hust.edu.cn	Huazhong University of Science and Technology	Han-Li Ruan	2024-05-01	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
ustus NRRL 5856		Not Available

Chemical Taxonomy

Description

This compound belongs to the class of organic compounds known as 4-prenylated xanthones. These are organic compounds containing a C5-isoprenoid group linked to a xanthone moiety at the 4-position. Xanthone is a tricyclic compound made up of two benzene rings linearly fused to each other through a pyran ring that carries a ketone group.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Benzopyrans

Sub Class

1-benzopyrans

Direct Parent

4-prenylated xanthones

Alternative Parents

Substituents

4-prenylated xanthone
Furanochromone
Chromone
Coumaran
Furofuran
1-hydroxy-4-unsubstituted benzenoid
1-hydroxy-2-unsubstituted benzenoid
Pyranone
Dihydropyranone
Alpha-branched alpha,beta-unsaturated-ketone
Benzenoid
Pyran
Beta-hydroxy ketone
Heteroaromatic compound
Vinylogous acid
Alpha,beta-unsaturated ketone
Tetrahydrofuran
Tertiary alcohol
Enone
Dihydrofuran
Acryloyl-group
Ketone
Oxacycle
Organic oxygen compound
Organic oxide
Hydrocarbon derivative
Organooxygen compound
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	4.3	ChemAxon
pKa (Strongest Acidic)	8.3	ChemAxon
pKa (Strongest Basic)	-2.6	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	7	ChemAxon
Hydrogen Donor Count	3	ChemAxon
Polar Surface Area	114.68 Å²	ChemAxon
Rotatable Bond Count	4	ChemAxon
Refractivity	110.25 m³·mol⁻¹	ChemAxon
Polarizability	43.86 Å³	ChemAxon
Number of Rings	5	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	Yes	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	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

Not Available

METLIN ID

Not Available

PubChem Compound

Not Available

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Chang JL, Gan YT, Zhou YH, Peng XG, Xie ZY, Meng X, Li SM, Ruan HL: Asperustins A-J: Austocystins with Immunosuppressive and Cytotoxic Activities from Aspergillus ustus NRRL 5856. J Nat Prod. 2024 Apr 26;87(4):966-975. doi: 10.1021/acs.jnatprod.3c01243. Epub 2024 Mar 5. [PubMed:38441877 ]

Showing NP-Card for Asperustin E (NP0332890)

MOL for NP0332890 (Asperustin E)

3D MOL for NP0332890 (Asperustin E)

3D SDF for NP0332890 (Asperustin E)

3D-SDF for NP0332890 (Asperustin E)

PDB for NP0332890 (Asperustin E)

3D PDB for NP0332890 (Asperustin E)

SMILES for NP0332890 (Asperustin E)

INCHI for NP0332890 (Asperustin E)

Structure for NP0332890 (Asperustin E)

3D Structure for NP0332890 (Asperustin E)