NP-MRD: Showing NP-Card for Dechlorogriseofulvin (NP0351727)

Jump To Section:

Identification Spectra BioTaxonomy ChemoTaxonomy Physical properties Links References XML

Record Information

Version

2.0

Created at

2025-11-05 02:16:18 UTC

Updated at

2025-12-20 01:35:13 UTC

NP-MRD ID

NP0351727

Natural Product DOI

https://doi.org/10.57994/4797

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Dechlorogriseofulvin

Description

Dechlorogriseofulvin belongs to the class of organic compounds known as benzofurans. These are organic compounds containing a benzene ring fused to a furan. Furan is a five-membered aromatic ring with four carbon atoms and one oxygen atom. Dechlorogriseofulvin was first documented in 2012 (PMID: 22782879). Based on a literature review a significant number of articles have been published on Dechlorogriseofulvin (PMID: 28409637) (PMID: 23827469) (PMID: 34885898) (PMID: 32165688) (PMID: 30837981) (PMID: 29944364).

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 41 43  0  0  0  0  0  0  0  0999 V2000
   -1.1602   -2.6688   -0.6596 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2510   -1.6598    0.3569 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1230   -0.5908    0.1170 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4243   -0.8302    0.1199 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3707    0.2531   -0.1253 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5652    0.1697    0.2195 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8429    1.4645   -0.8075 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5608    1.8427   -0.1225 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.8930    2.3560    1.2528 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5360    0.7624   -0.1292 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.8317    0.6876   -1.3499 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4629    0.2952   -1.0649 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4890   -0.2437   -1.8592 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7253   -0.5659   -1.3534 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7267   -1.1030   -2.1779 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0005   -1.4349   -1.6575 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9538   -0.3463   -0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9731    0.1811    0.8021 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1619    0.4174    2.1551 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4279    0.0931    2.6979 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7390    0.4956    0.2657 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4591    1.0531    0.8745 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5068    1.6227    1.9708 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1622   -3.1212   -0.8072 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9016   -2.1973   -1.6484 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3694   -3.3874   -0.4484 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7819   -1.8510    0.3087 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5419    2.3282   -0.7076 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7056    1.2547   -1.8973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1438    2.7207   -0.6934 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9134    2.7897    1.2150 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9216    1.5579    2.0235 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1924    3.1755    1.5136 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2861   -0.4077   -2.9118 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3478   -0.5967   -0.9844 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7179   -1.6424   -2.4514 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8873   -2.3278   -1.0045 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9023   -0.5764    0.4529 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5091    0.4387    3.7598 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5927   -0.9974    2.6181 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2552    0.5892    2.1497 H   0  0  0  0  0  0  0  0  0  0  0  0
  8  9  1  0
  8  7  1  0
  7  5  1  0
  5  6  2  0
  5  4  1  0
  4  3  2  0
  3  2  1  0
  2  1  1  0
  3 10  1  0
 10 11  1  6
 11 12  1  0
 12 13  2  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 14 17  2  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 18 21  2  0
 21 22  1  0
 22 23  2  0
 10  8  1  0
 22 10  1  0
 21 12  1  0
  8 30  1  6
  9 31  1  0
  9 32  1  0
  9 33  1  0
  7 28  1  0
  7 29  1  0
  4 27  1  0
  1 24  1  0
  1 25  1  0
  1 26  1  0
 13 34  1  0
 16 35  1  0
 16 36  1  0
 16 37  1  0
 17 38  1  0
 20 39  1  0
 20 40  1  0
 20 41  1  0
M  END


  Mrv1652305312218352D          

 24 26  0  0  1  0            999 V2000
    3.5235    1.8414    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1110    1.1270    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.6985    1.8414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9360    1.1270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3485    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1735    0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9360   -0.3020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1110   -0.3020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6985   -1.0164    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1110   -1.7309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6985    0.4125    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.2136   -0.2549    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2136    1.0799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2136    1.9049    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  1  0  0  0
  2  3  1  6  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  8 11  1  0  0  0  0
  2 11  1  0  0  0  0
 11 12  1  1  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 15 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 19 22  2  0  0  0  0
 13 22  1  0  0  0  0
 22 23  1  0  0  0  0
 11 23  1  0  0  0  0
 23 24  2  0  0  0  0
M  END
> <DATABASE_ID>
NP0351727

> <DATABASE_NAME>
NP-MRD

> <SMILES>
[H][C@@]1(C)CC(=O)C=C(OC)[C@@]11OC2=CC(OC)=CC(OC)=C2C1=O

> <INCHI_IDENTIFIER>
InChI=1S/C17H18O6/c1-9-5-10(18)6-14(22-4)17(9)16(19)15-12(21-3)7-11(20-2)8-13(15)23-17/h6-9H,5H2,1-4H3/t9-,17+/m1/s1

> <INCHI_KEY>
QPCYNIYZPDJCMB-XLFHBGCDSA-N

> <FORMULA>
C17H18O6

> <MOLECULAR_WEIGHT>
318.325

> <EXACT_MASS>
318.1103383

> <JCHEM_ACCEPTOR_COUNT>
6

> <JCHEM_ATOM_COUNT>
41

> <JCHEM_AVERAGE_POLARIZABILITY>
32.138181160338426

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
(2S,6'R)-2',4,6-trimethoxy-6'-methyl-3H-spiro[1-benzofuran-2,1'-cyclohexan]-2'-ene-3,4'-dione

> <JCHEM_LOGP>
1.5680927819999995

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_ACIDIC>
17.68745877656876

> <JCHEM_PKA_STRONGEST_BASIC>
-4.299949375512701

> <JCHEM_POLAR_SURFACE_AREA>
71.06

> <JCHEM_REFRACTIVITY>
83.04109999999997

> <JCHEM_ROTATABLE_BOND_COUNT>
3

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
(2S,6'R)-2',4,6-trimethoxy-6'-methylspiro[1-benzofuran-2,1'-cyclohexan]-2'-ene-3,4'-dione

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 31-MAY-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   31-MAY-22         0                                  
HETATM    1  H   UNK     0       6.577   3.437   0.000  0.00  0.00           H+0
HETATM    2  C   UNK     0       5.807   2.104   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       5.037   3.437   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       7.347   2.104   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       8.117   0.770   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0       9.657   0.770   0.000  0.00  0.00           O+0
HETATM    7  C   UNK     0       7.347  -0.564   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       5.807  -0.564   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0       5.037  -1.897   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0       5.807  -3.231   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       5.037   0.770   0.000  0.00  0.00           C+0
HETATM   12  O   UNK     0       4.132  -0.476   0.000  0.00  0.00           O+0
HETATM   13  C   UNK     0       2.667   0.000   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       1.334  -0.770   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -0.000   0.000   0.000  0.00  0.00           C+0
HETATM   16  O   UNK     0      -1.334  -0.770   0.000  0.00  0.00           O+0
HETATM   17  C   UNK     0      -2.667   0.000   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       0.000   1.540   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       1.334   2.310   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0       1.334   3.850   0.000  0.00  0.00           O+0
HETATM   21  C   UNK     0       0.000   4.620   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       2.667   1.540   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       4.132   2.016   0.000  0.00  0.00           C+0
HETATM   24  O   UNK     0       4.132   3.556   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3    4   11                                             
CONECT    3    2                                                            
CONECT    4    2    5                                                       
CONECT    5    4    6    7                                                  
CONECT    6    5                                                            
CONECT    7    5    8                                                       
CONECT    8    7    9   11                                                  
CONECT    9    8   10                                                       
CONECT   10    9                                                            
CONECT   11    8    2   12   23                                             
CONECT   12   11   13                                                       
CONECT   13   12   14   22                                                  
CONECT   14   13   15                                                       
CONECT   15   14   16   18                                                  
CONECT   16   15   17                                                       
CONECT   17   16                                                            
CONECT   18   15   19                                                       
CONECT   19   18   20   22                                                  
CONECT   20   19   21                                                       
CONECT   21   20                                                            
CONECT   22   19   13   23                                                  
CONECT   23   22   11   24                                                  
CONECT   24   23                                                            
MASTER        0    0    0    0    0    0    0    0   24    0   52    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₁₇H₁₈O₆

Average Mass

318.3250 Da

Monoisotopic Mass

318.11034 Da

IUPAC Name

(2S,6'R)-2',4,6-trimethoxy-6'-methyl-3H-spiro[1-benzofuran-2,1'-cyclohexan]-2'-ene-3,4'-dione

Traditional Name

(2S,6'R)-2',4,6-trimethoxy-6'-methylspiro[1-benzofuran-2,1'-cyclohexan]-2'-ene-3,4'-dione

CAS Registry Number

Not Available

SMILES

[H][C@@]1(C)CC(=O)C=C(OC)[C@@]11OC2=CC(OC)=CC(OC)=C2C1=O

InChI Identifier

InChI=1S/C17H18O6/c1-9-5-10(18)6-14(22-4)17(9)16(19)15-12(21-3)7-11(20-2)8-13(15)23-17/h6-9H,5H2,1-4H3/t9-,17+/m1/s1

InChI Key

QPCYNIYZPDJCMB-XLFHBGCDSA-N

Experimental Spectra

Spectrum Type	Description	Depositor Email	Depositor Organization	Depositor	Deposition Date	View
HMBC NMR	[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, C2D6OS, experimental)	[email protected]	Not Available	Not Available	2025-11-05	View Spectrum
HSQC NMR	[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, C2D6OS, experimental)	[email protected]	Not Available	Not Available	2025-11-05	View Spectrum
COSY NMR	[¹H, ¹H] NMR Spectrum (2D, 500 MHz, C2D6OS, experimental)	[email protected]	Not Available	Not Available	2025-11-05	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 126 MHz, C2D6OS, experimental)	[email protected]	Not Available	Not Available	2025-11-05	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 500 MHz, C2D6OS, experimental)	[email protected]	Not Available	Not Available	2025-11-05	View Spectrum

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

Spectrum Type	Description	Depositor Email	Depositor Organization	Depositor	Deposition Date	View
1D NMR	¹H NMR Spectrum (1D, 500.0, C2D6OS, simulated)	[email protected]	Not Available	Not Available	2025-11-05	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 125.0, C2D6OS, simulated)	[email protected]	Not Available	Not Available	2025-11-05	View Spectrum

Species

Species of Origin

Species Name	Source	Reference
Penicillium Penicillium janczewskii		Not Available
Penicillium Penicillium janczewskii		Not Available

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as benzofurans. These are organic compounds containing a benzene ring fused to a furan. Furan is a five-membered aromatic ring with four carbon atoms and one oxygen atom.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Benzofurans

Sub Class

Not Available

Direct Parent

Benzofurans

Alternative Parents

Substituents

Coumaran
Benzofuran
Anisole
Aryl alkyl ketone
Aryl ketone
Phenol ether
Alkyl aryl ether
Cyclohexenone
Benzenoid
Vinylogous ester
Ketone
Cyclic ketone
Ether
Oxacycle
Organic oxygen compound
Carbonyl group
Hydrocarbon derivative
Organic oxide
Organooxygen compound
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	1.57	ChemAxon
pKa (Strongest Acidic)	17.69	ChemAxon
pKa (Strongest Basic)	-4.3	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	6	ChemAxon
Hydrogen Donor Count	0	ChemAxon
Polar Surface Area	71.06 Å²	ChemAxon
Rotatable Bond Count	3	ChemAxon
Refractivity	83.04 m³·mol⁻¹	ChemAxon
Polarizability	32.14 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

C00043443

Chemspider ID

23550443

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

24066885

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Shang Z, Li XM, Li CS, Wang BG: Diverse secondary metabolites produced by marine-derived fungus Nigrospora sp. MA75 on various culture media. Chem Biodivers. 2012 Jul;9(7):1338-48. doi: 10.1002/cbdv.201100216. [PubMed:22782879 ]
Ali T, Inagaki M, Chai HB, Wieboldt T, Rapplye C, Rakotondraibe LH: Halogenated Compounds from Directed Fermentation of Penicillium concentricum, an Endophytic Fungus of the Liverwort Trichocolea tomentella. J Nat Prod. 2017 May 26;80(5):1397-1403. doi: 10.1021/acs.jnatprod.6b01069. Epub 2017 Apr 14. [PubMed:28409637 ]
Wubshet SG, Nyberg NT, Tejesvi MV, Pirttila AM, Kajula M, Mattila S, Staerk D: Targeting high-performance liquid chromatography-high-resolution mass spectrometry-solid-phase extraction-nuclear magnetic resonance analysis with high-resolution radical scavenging profiles-Bioactive secondary metabolites from the endophytic fungus Penicillium namyslowskii. J Chromatogr A. 2013 Aug 9;1302:34-9. doi: 10.1016/j.chroma.2013.05.032. Epub 2013 May 22. [PubMed:23827469 ]
Farinella VF, Kawafune ES, Tangerina MMP, Domingos HV, Costa-Lotufo LV, Ferreira MJP: OSMAC Strategy Integrated with Molecular Networking for Accessing Griseofulvin Derivatives from Endophytic Fungi of Moquiniastrum polymorphum (Asteraceae). Molecules. 2021 Dec 2;26(23). pii: molecules26237316. doi: 10.3390/molecules26237316. [PubMed:34885898 ]
Ibrahim A, Tanney JB, Fei F, Seifert KA, Cutler GC, Capretta A, Miller JD, Sumarah MW: Metabolomic-guided discovery of cyclic nonribosomal peptides from Xylaria ellisii sp. nov., a leaf and stem endophyte of Vaccinium angustifolium. Sci Rep. 2020 Mar 12;10(1):4599. doi: 10.1038/s41598-020-61088-x. [PubMed:32165688 ]
Knowles SL, Raja HA, Wright AJ, Lee AML, Caesar LK, Cech NB, Mead ME, Steenwyk JL, Ries LNA, Goldman GH, Rokas A, Oberlies NH: Mapping the Fungal Battlefield: Using in situ Chemistry and Deletion Mutants to Monitor Interspecific Chemical Interactions Between Fungi. Front Microbiol. 2019 Feb 19;10:285. doi: 10.3389/fmicb.2019.00285. eCollection 2019. [PubMed:30837981 ]
Ribeiro AI, Costa ES, Thomasi SS, Brandao DFR, Vieira PC, Fernandes JB, Forim MR, Ferreira AG, Pascholati SF, Gusmao LFP, da Silva MFDGF: Biological and Chemical Control of Sclerotinia sclerotiorum using Stachybotrys levispora and Its Secondary Metabolite Griseofulvin. J Agric Food Chem. 2018 Jul 25;66(29):7627-7632. doi: 10.1021/acs.jafc.7b04197. Epub 2018 Jul 10. [PubMed:29944364 ]
Hazalin NA, Ramasamy K, Lim SM, Cole AL, Majeed AB: Induction of apoptosis against cancer cell lines by four ascomycetes (endophytes) from Malaysian rainforest. Phytomedicine. 2012 May 15;19(7):609-17. doi: 10.1016/j.phymed.2012.01.007. Epub 2012 Mar 6. [PubMed:22397996 ]
Brooks WC, Paguigan ND, Raja HA, Moy FJ, Cech NB, Pearce CJ, Oberlies NH: qNMR for profiling the production of fungal secondary metabolites. Magn Reson Chem. 2017 Jul;55(7):670-676. doi: 10.1002/mrc.4571. Epub 2017 Feb 5. [PubMed:28024162 ]
Zhao JH, Zhang YL, Wang LW, Wang JY, Zhang CL: Bioactive secondary metabolites from Nigrospora sp. LLGLM003, an endophytic fungus of the medicinal plant Moringa oleifera Lam. World J Microbiol Biotechnol. 2012 May;28(5):2107-12. doi: 10.1007/s11274-012-1015-4. Epub 2012 Feb 12. [PubMed:22806033 ]

Showing NP-Card for Dechlorogriseofulvin (NP0351727)

MOL for NP0351727 (Dechlorogriseofulvin)

3D MOL for NP0351727 (Dechlorogriseofulvin)

3D SDF for NP0351727 (Dechlorogriseofulvin)

3D-SDF for NP0351727 (Dechlorogriseofulvin)

PDB for NP0351727 (Dechlorogriseofulvin)

3D PDB for NP0351727 (Dechlorogriseofulvin)

SMILES for NP0351727 (Dechlorogriseofulvin)

INCHI for NP0351727 (Dechlorogriseofulvin)

Structure for NP0351727 (Dechlorogriseofulvin)

3D Structure for NP0351727 (Dechlorogriseofulvin)