NP-MRD: Showing NP-Card for (+)-chloromonilicin (NP0319030)

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Record Information

Version

2.0

Created at

2022-09-11 19:51:29 UTC

Updated at

2022-09-11 19:51:30 UTC

NP-MRD ID

NP0319030

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(+)-chloromonilicin

Description

Chloromonilicin belongs to the class of organic compounds known as chromones. Chromones are compounds containing a benzopyran-4-one moiety. Chloromonilicin is a secondary metabolite. Secondary metabolites are metabolically or physiologically non-essential metabolites that may serve a role as defense or signalling molecules. In some cases they are simply molecules that arise from the incomplete metabolism of other secondary metabolites. (+)-chloromonilicin is found in Monilinia fructicola. (+)-chloromonilicin was first documented in 1985 (PMID: 3839228). Based on a literature review a small amount of articles have been published on chloromonilicin (PMID: 34201288) (PMID: 32286920) (PMID: 31947939) (PMID: 26174176).

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 35 37  0  0  0  0  0  0  0  0999 V2000
   -4.9503    1.1209   -1.1896 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1384    0.4505   -0.2433 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8765    0.8709    0.1072 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3807    1.8933   -0.4119 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1031    0.1085    1.1034 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.8782   -0.9863    1.5290 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0883   -2.2489    0.9989 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2384   -2.7373    1.2314 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1566   -3.0302    0.2364 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9357   -2.6992   -0.1743 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1113   -3.9262   -1.0817 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.2651   -1.4238    0.0751 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9867   -1.5114   -0.2999 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8353   -0.5251   -0.1981 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1420   -0.6761   -0.6097 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0229    0.3641   -0.4985 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4461    0.2309   -0.9362 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5952    1.5463    0.0219 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2754    1.7580    0.4578 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9583    2.9702    0.9579 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4170    0.6764    0.3262 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0973    0.8040    0.7336 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3063    1.8861    1.2132 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7806   -0.2658    0.6114 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5820    1.8360   -0.5858 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5739    0.3735   -1.6876 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2738    1.6809   -1.8594 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9510    0.7953    1.9876 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5155   -4.0242   -0.0326 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4626   -1.6233   -1.0206 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0268   -0.1270   -0.0639 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4880   -0.5344   -1.7364 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8605    1.1783   -1.2997 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2957    2.3609    0.1060 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1960    3.4342    1.3260 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  2  0
 10 11  1  0
 10 12  1  0
 12 24  2  0
 24 22  1  0
 22 23  2  0
 22 21  1  0
 21 19  2  0
 19 20  1  0
 19 18  1  0
 18 16  2  0
 16 17  1  0
 16 15  1  0
 15 14  2  0
 14 13  1  0
 24  5  1  0
 14 21  1  0
 13 12  1  0
  1 25  1  0
  1 26  1  0
  1 27  1  0
  5 28  1  1
  9 29  1  0
 20 35  1  0
 18 34  1  0
 17 31  1  0
 17 32  1  0
 17 33  1  0
 15 30  1  0
M  END


  Mrv1652309112221512D          

 24 26  0  0  1  0            999 V2000
    0.8305   -2.6842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6469   -1.8798    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2517   -1.3187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0400   -1.5619    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0681   -0.5144    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.2638   -0.3308    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0942    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9192    0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2638    1.1558    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0681    1.3394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2517    2.1437    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.7131    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4276    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1421    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8565    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5710    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2855    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5710   -0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8565   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8565   -1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1421    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4276   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4276   -1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7131   -0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  5  3  1  1  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 21  2  0  0  0  0
 14 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
 12 24  2  0  0  0  0
  5 24  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0319030

> <DATABASE_NAME>
NP-MRD

> <SMILES>
COC(=O)[C@H]1OC(=O)C=C(Cl)C2=C1C(=O)C1=C(O)C=C(C)C=C1O2

> <INCHI_IDENTIFIER>
InChI=1S/C16H11ClO7/c1-6-3-8(18)11-9(4-6)23-14-7(17)5-10(19)24-15(16(21)22-2)12(14)13(11)20/h3-5,15,18H,1-2H3/t15-/m0/s1

> <INCHI_KEY>
XEADRORPHLTLNQ-HNNXBMFYSA-N

> <FORMULA>
C16H11ClO7

> <MOLECULAR_WEIGHT>
350.71

> <EXACT_MASS>
350.0193304

> <JCHEM_ACCEPTOR_COUNT>
5

> <JCHEM_ATOM_COUNT>
35

> <JCHEM_AVERAGE_POLARIZABILITY>
32.59826322657729

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
methyl (1S)-5-chloro-10-hydroxy-8-methyl-3,11-dioxo-1H,3H,11H-oxepino[4,3-b]chromene-1-carboxylate

> <JCHEM_LOGP>
2.617170123333333

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
12.395994685849335

> <JCHEM_PKA_STRONGEST_ACIDIC>
7.480033840836178

> <JCHEM_PKA_STRONGEST_BASIC>
-5.408938344079974

> <JCHEM_POLAR_SURFACE_AREA>
99.13000000000001

> <JCHEM_REFRACTIVITY>
83.81379999999999

> <JCHEM_ROTATABLE_BOND_COUNT>
2

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
methyl (1S)-5-chloro-10-hydroxy-8-methyl-3,11-dioxo-1H-oxepino[4,3-b]chromene-1-carboxylate

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 11-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   11-SEP-22         0                                  
HETATM    1  C   UNK     0       1.550  -5.010   0.000  0.00  0.00           C+0
HETATM    2  O   UNK     0       1.208  -3.509   0.000  0.00  0.00           O+0
HETATM    3  C   UNK     0       2.337  -2.462   0.000  0.00  0.00           C+0
HETATM    4  O   UNK     0       3.808  -2.915   0.000  0.00  0.00           O+0
HETATM    5  C   UNK     0       1.994  -0.960   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0       0.492  -0.617   0.000  0.00  0.00           O+0
HETATM    7  C   UNK     0      -0.176   0.770   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0      -1.716   0.770   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0       0.492   2.157   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       1.994   2.500   0.000  0.00  0.00           C+0
HETATM   11 Cl   UNK     0       2.337   4.002   0.000  0.00  0.00          Cl+0
HETATM   12  C   UNK     0       3.198   1.540   0.000  0.00  0.00           C+0
HETATM   13  O   UNK     0       4.532   2.310   0.000  0.00  0.00           O+0
HETATM   14  C   UNK     0       5.865   1.540   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       7.199   2.310   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       8.533   1.540   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       9.866   2.310   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       8.533  -0.000   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       7.199  -0.770   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0       7.199  -2.310   0.000  0.00  0.00           O+0
HETATM   21  C   UNK     0       5.865   0.000   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       4.532  -0.770   0.000  0.00  0.00           C+0
HETATM   23  O   UNK     0       4.532  -2.310   0.000  0.00  0.00           O+0
HETATM   24  C   UNK     0       3.198  -0.000   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4    5                                                  
CONECT    4    3                                                            
CONECT    5    3    6   24                                                  
CONECT    6    5    7                                                       
CONECT    7    6    8    9                                                  
CONECT    8    7                                                            
CONECT    9    7   10                                                       
CONECT   10    9   11   12                                                  
CONECT   11   10                                                            
CONECT   12   10   13   24                                                  
CONECT   13   12   14                                                       
CONECT   14   13   15   21                                                  
CONECT   15   14   16                                                       
CONECT   16   15   17   18                                                  
CONECT   17   16                                                            
CONECT   18   16   19                                                       
CONECT   19   18   20   21                                                  
CONECT   20   19                                                            
CONECT   21   19   14   22                                                  
CONECT   22   21   23   24                                                  
CONECT   23   22                                                            
CONECT   24   22   12    5                                                  
MASTER        0    0    0    0    0    0    0    0   24    0   52    0
END

View in JSmol

Synonyms

Value	Source
(+)-Chloromonilicin	ChEBI
(1S)-Chloromonilicin	ChEBI
(S)-Chloromonilicin	ChEBI

Chemical Formula

C₁₆H₁₁ClO₇

Average Mass

350.7100 Da

Monoisotopic Mass

350.01933 Da

IUPAC Name

methyl (1S)-5-chloro-10-hydroxy-8-methyl-3,11-dioxo-1H,3H,11H-oxepino[4,3-b]chromene-1-carboxylate

Traditional Name

methyl (1S)-5-chloro-10-hydroxy-8-methyl-3,11-dioxo-1H-oxepino[4,3-b]chromene-1-carboxylate

CAS Registry Number

Not Available

SMILES

COC(=O)[C@H]1OC(=O)C=C(Cl)C2=C1C(=O)C1=C(O)C=C(C)C=C1O2

InChI Identifier

InChI=1S/C16H11ClO7/c1-6-3-8(18)11-9(4-6)23-14-7(17)5-10(19)24-15(16(21)22-2)12(14)13(11)20/h3-5,15,18H,1-2H3/t15-/m0/s1

InChI Key

XEADRORPHLTLNQ-HNNXBMFYSA-N

Experimental Spectra

Not Available

Predicted Spectra

Spectrum Type	Description	Depositor ID	Depositor Organization	Depositor	Deposition Date	View
1D NMR	¹³C NMR Spectrum (1D, 25 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 100 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 252 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 1000 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 50 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 200 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 75 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 300 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 101 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 400 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 126 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 500 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 151 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 176 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 700 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 201 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 800 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 226 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 900 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Monilinia fructicola	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as chromones. Chromones are compounds containing a benzopyran-4-one moiety.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Benzopyrans

Sub Class

1-benzopyrans

Direct Parent

Chromones

Alternative Parents

Substituents

Chromone
1-hydroxy-4-unsubstituted benzenoid
1-hydroxy-2-unsubstituted benzenoid
Pyranone
Dicarboxylic acid or derivatives
Pyran
Benzenoid
Heteroaromatic compound
Vinylogous acid
Vinylogous halide
Alpha,beta-unsaturated carboxylic ester
Enoate ester
Methyl ester
Carboxylic acid ester
Lactone
Carboxylic acid derivative
Oxacycle
Chloroalkene
Haloalkene
Vinyl chloride
Vinyl halide
Organohalogen compound
Carbonyl group
Organochloride
Organooxygen compound
Organic oxygen compound
Organic oxide
Hydrocarbon derivative
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	2.62	ChemAxon
pKa (Strongest Acidic)	7.48	ChemAxon
pKa (Strongest Basic)	-5.4	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	5	ChemAxon
Hydrogen Donor Count	1	ChemAxon
Polar Surface Area	99.13 Å²	ChemAxon
Rotatable Bond Count	2	ChemAxon
Refractivity	83.81 m³·mol⁻¹	ChemAxon
Polarizability	32.6 Å³	ChemAxon
Number of Rings	3	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

C00018634

Chemspider ID

58828188

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

121225493

PDB ID

Not Available

ChEBI ID

70291

Good Scents ID

Not Available

References

General References

Sassa T, Kachi H, Nukina M, Suzuki Y: Chloromonilicin, a new antifungal metabolite produced by Monilinia fructicola. J Antibiot (Tokyo). 1985 Mar;38(3):439-41. doi: 10.7164/antibiotics.38.439. [PubMed:3839228 ]
Marcet-Houben M, Villarino M, Vilanova L, De Cal A, van Kan JAL, Usall J, Gabaldon T, Torres R: Comparative Genomics Used to Predict Virulence Factors and Metabolic Genes among Monilinia Species. J Fungi (Basel). 2021 Jun 8;7(6):464. doi: 10.3390/jof7060464. [PubMed:34201288 ]
Yu FY, Chiu CM, Lee YZ, Lee SJ, Chou CM, You BJ, Hsieh DK, Lee MR, Lee MH, Bostock RM: Polyketide Synthase Gene Expression in Relation to Chloromonilicin and Melanin Production in Monilinia fructicola. Phytopathology. 2020 Aug;110(8):1465-1475. doi: 10.1094/PHYTO-02-20-0059-R. Epub 2020 Jun 29. [PubMed:32286920 ]
Dalinova A, Chisty L, Kochura D, Garnyuk V, Petrova M, Prokofieva D, Yurchenko A, Dubovik V, Ivanov A, Smirnov S, Zolotarev A, Berestetskiy A: Isolation and Bioactivity of Secondary Metabolites from Solid Culture of the Fungus, Alternaria sonchi. Biomolecules. 2020 Jan 4;10(1):81. doi: 10.3390/biom10010081. [PubMed:31947939 ]
Cimmino A, Pescitelli G, Berestetskiy A, Dalinova A, Krivorotov D, Tuzi A, Evidente A: Biological evaluation and determination of the absolute configuration of chloromonilicin, a strong antimicrobial metabolite isolated from Alternaria sonchi. J Antibiot (Tokyo). 2016 Jan;69(1):9-14. doi: 10.1038/ja.2015.74. Epub 2015 Jul 15. [PubMed:26174176 ]
LOTUS database [Link]

Showing NP-Card for (+)-chloromonilicin (NP0319030)

MOL for NP0319030 ((+)-chloromonilicin)

3D MOL for NP0319030 ((+)-chloromonilicin)

3D SDF for NP0319030 ((+)-chloromonilicin)

3D-SDF for NP0319030 ((+)-chloromonilicin)

PDB for NP0319030 ((+)-chloromonilicin)

3D PDB for NP0319030 ((+)-chloromonilicin)

SMILES for NP0319030 ((+)-chloromonilicin)

INCHI for NP0319030 ((+)-chloromonilicin)

Structure for NP0319030 ((+)-chloromonilicin)

3D Structure for NP0319030 ((+)-chloromonilicin)