NP-MRD: Showing NP-Card for Asperxanthone (NP0085148)

Jump To Section:

Identification Spectra BioTaxonomy ChemoTaxonomy Physical properties Links References XML

Record Information

Version

2.0

Created at

2022-04-29 05:45:22 UTC

Updated at

2022-04-29 05:45:22 UTC

NP-MRD ID

NP0085148

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Asperxanthone

Description

Asperxanthone, also known as TMC 256C2, belongs to the class of organic compounds known as naphthopyranones. Naphthopyranones are compounds containing a naphthopyran skeleton where a ring carbon bears a carboxylic acid group. Naphthtopyran is made up of the pyran ring fused to a naphthalene ring system. Asperxanthone is an extremely weak basic (essentially neutral) compound (based on its pKa). Outside of the human body, Asperxanthone has been detected, but not quantified in, fruits and nuts. Asperxanthone is found in Aspergillus niger. Asperxanthone was first documented in 1984 (PMID: 6548104). This could make asperxanthone a potential biomarker for the consumption of these foods (PMID: 18205129) (PMID: 25809933) (PMID: 26669099) (PMID: 21652743) (PMID: 18823067) (PMID: 19160525).

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 35 37  0  0  0  0  0  0  0  0999 V2000
    5.2919   -0.4580    0.3230 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3500    0.5775    0.4417 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9725    0.3369    0.2907 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0666    1.3681    0.4114 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7027    1.1188    0.2598 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2343    2.1313    0.3746 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1731    3.4450    0.6490 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2273   -0.1532   -0.0121 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1326   -1.1793   -0.1318 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4958   -0.9275    0.0201 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6440   -2.4250   -0.3999 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7272   -2.7144   -0.5594 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1236   -3.9813   -0.8243 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6196   -1.6825   -0.4376 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9711   -1.8111   -0.5658 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4732   -2.9377   -0.8129 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7672   -0.6906   -0.4202 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2354    0.5476   -0.1502 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1373    1.7382    0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9370    0.6373   -0.0332 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1418   -0.4036   -0.1642 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2778   -0.0967    0.6130 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2770   -0.7905   -0.7417 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0482   -1.3470    0.9499 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4122    2.3761    0.6245 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7181    4.0189    1.0352 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5018    4.0016   -0.2606 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9364    3.5247    1.4413 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1739   -1.7466   -0.0789 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3430   -3.2427   -0.4971 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9759   -4.3876   -0.9653 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8310   -0.8277   -0.5278 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6235    2.5737    0.4868 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5464    1.9880   -1.0059 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9643    1.4193    0.6678 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
  4  5  1  0
  5  6  1  0
  6  7  1  0
  5  8  2  0
  8  9  1  0
  9 11  1  0
 11 12  2  0
 12 13  1  0
 12 14  1  0
 14 21  2  0
 21 20  1  0
 20 18  1  0
 18 19  1  0
 18 17  2  0
 17 15  1  0
 15 16  2  0
  9 10  2  0
 10  3  1  0
 21  8  1  0
 15 14  1  0
  1 22  1  0
  1 23  1  0
  1 24  1  0
  4 25  1  0
  7 26  1  0
  7 27  1  0
  7 28  1  0
 11 30  1  0
 13 31  1  0
 19 33  1  0
 19 34  1  0
 19 35  1  0
 17 32  1  0
 10 29  1  0
M  END


  Mrv0541 05061305332D          

 21 23  0  0  0  0            999 V2000
    0.6039    3.0789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9664    2.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2539    3.0789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6039    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3164    0.9355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0789    0.2211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3164    2.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0164    2.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4914    0.9355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7289    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0164    0.9355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2539    0.2211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4914    2.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0789    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8414    0.9355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2539    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6039    0.2211    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8414   -0.4934    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5539    1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0789    3.0789    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8414    2.3645    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  8  1  1  0  0  0  0
  8  4  2  0  0  0  0
  9  5  2  0  0  0  0
  9  6  1  0  0  0  0
 10  5  1  0  0  0  0
 10  7  2  0  0  0  0
 11  4  1  0  0  0  0
 12  6  2  0  0  0  0
 13  7  1  0  0  0  0
 14  9  1  0  0  0  0
 14 13  2  0  0  0  0
 15 11  1  0  0  0  0
 15 12  1  0  0  0  0
 16 14  1  0  0  0  0
 16 15  2  0  0  0  0
 17 11  2  0  0  0  0
 18 12  1  0  0  0  0
 19  2  1  0  0  0  0
 19 10  1  0  0  0  0
 20  3  1  0  0  0  0
 20 13  1  0  0  0  0
 21  8  1  0  0  0  0
 21 16  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0085148

> <DATABASE_NAME>
NP-MRD

> <SMILES>
COC1=CC(OC)=C2C(C=C(O)C3=C2OC(C)=CC3=O)=C1

> <INCHI_IDENTIFIER>
InChI=1S/C16H14O5/c1-8-4-11(17)15-12(18)6-9-5-10(19-2)7-13(20-3)14(9)16(15)21-8/h4-7,18H,1-3H3

> <INCHI_KEY>
ARXPDHLVDOYIPX-UHFFFAOYSA-N

> <FORMULA>
C16H14O5

> <MOLECULAR_WEIGHT>
286.2794

> <EXACT_MASS>
286.084123558

> <JCHEM_ACCEPTOR_COUNT>
5

> <JCHEM_AVERAGE_POLARIZABILITY>
29.240617625656768

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
5-hydroxy-8,10-dimethoxy-2-methyl-4H-benzo[h]chromen-4-one

> <ALOGPS_LOGP>
2.95

> <JCHEM_LOGP>
2.8921221729999997

> <ALOGPS_LOGS>
-3.56

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
15.816314133038201

> <JCHEM_PKA_STRONGEST_ACIDIC>
8.397204320523224

> <JCHEM_PKA_STRONGEST_BASIC>
-4.492396726526867

> <JCHEM_POLAR_SURFACE_AREA>
64.99000000000001

> <JCHEM_REFRACTIVITY>
78.46470000000001

> <JCHEM_ROTATABLE_BOND_COUNT>
2

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
7.89e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
5-hydroxy-8,10-dimethoxy-2-methylbenzo[h]chromen-4-one

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 06-MAY-13   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-MAY-13         0                                  
HETATM    1  C   UNK     0       1.127   5.747   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      11.137   4.414   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       4.207   5.747   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       1.127   3.080   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       8.057   1.746   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       5.747   0.413   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       8.057   4.414   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       1.897   4.414   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       6.517   1.746   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       8.827   3.080   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       1.897   1.746   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       4.207   0.413   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       6.517   4.414   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       5.747   3.080   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       3.437   1.746   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       4.207   3.080   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0       1.127   0.413   0.000  0.00  0.00           O+0
HETATM   18  O   UNK     0       3.437  -0.921   0.000  0.00  0.00           O+0
HETATM   19  O   UNK     0      10.367   3.080   0.000  0.00  0.00           O+0
HETATM   20  O   UNK     0       5.747   5.747   0.000  0.00  0.00           O+0
HETATM   21  O   UNK     0       3.437   4.414   0.000  0.00  0.00           O+0
CONECT    1    8                                                            
CONECT    2   19                                                            
CONECT    3   20                                                            
CONECT    4    8   11                                                       
CONECT    5    9   10                                                       
CONECT    6    9   12                                                       
CONECT    7   10   13                                                       
CONECT    8    1    4   21                                                  
CONECT    9    5    6   14                                                  
CONECT   10    5    7   19                                                  
CONECT   11    4   15   17                                                  
CONECT   12    6   15   18                                                  
CONECT   13    7   14   20                                                  
CONECT   14    9   13   16                                                  
CONECT   15   11   12   16                                                  
CONECT   16   14   15   21                                                  
CONECT   17   11                                                            
CONECT   18   12                                                            
CONECT   19    2   10                                                       
CONECT   20    3   13                                                       
CONECT   21    8   16                                                       
MASTER        0    0    0    0    0    0    0    0   21    0   46    0
END

View in JSmol

Synonyms

Value	Source
Antibiotic TMC 256c2	ChEBI
Asperxanthon	ChEBI
TMC 256c2	ChEBI
5-Hydroxy-8,10-dimethoxy-2-methyl-4H-naphtho[1,2-b]pyran-4-one, 9ci	HMDB
Flavasperone	HMDB
Asperxanthone	ChEBI

Chemical Formula

C₁₆H₁₄O₅

Average Mass

286.2794 Da

Monoisotopic Mass

286.08412 Da

IUPAC Name

5-hydroxy-8,10-dimethoxy-2-methyl-4H-benzo[h]chromen-4-one

Traditional Name

5-hydroxy-8,10-dimethoxy-2-methylbenzo[h]chromen-4-one

CAS Registry Number

Not Available

SMILES

COC1=CC(OC)=C2C(C=C(O)C3=C2OC(C)=CC3=O)=C1

InChI Identifier

InChI=1S/C16H14O5/c1-8-4-11(17)15-12(18)6-9-5-10(19-2)7-13(20-3)14(9)16(15)21-8/h4-7,18H,1-3H3

InChI Key

ARXPDHLVDOYIPX-UHFFFAOYSA-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, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 252 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 50 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 75 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 101 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 126 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 151 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 176 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 201 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 226 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, 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
Aspergillus niger	Fungi	KNApSAcK

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as naphthopyranones. Naphthopyranones are compounds containing a naphthopyran skeleton where a ring carbon bears a carboxylic acid group. Naphthtopyran is made up of the pyran ring fused to a naphthalene ring system.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Naphthopyrans

Sub Class

Naphthopyranones

Direct Parent

Naphthopyranones

Alternative Parents

Substituents

Naphthopyranone
Chromone
2-naphthol
Benzopyran
1-benzopyran
Naphthalene
Anisole
1-hydroxy-2-unsubstituted benzenoid
Alkyl aryl ether
Pyranone
Benzenoid
Pyran
Heteroaromatic compound
Vinylogous acid
Oxacycle
Ether
Organic oxygen compound
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	2.95	ALOGPS
logP	2.89	ChemAxon
logS	-3.6	ALOGPS
pKa (Strongest Acidic)	8.4	ChemAxon
pKa (Strongest Basic)	-4.5	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	5	ChemAxon
Hydrogen Donor Count	1	ChemAxon
Polar Surface Area	64.99 Å²	ChemAxon
Rotatable Bond Count	2	ChemAxon
Refractivity	78.46 m³·mol⁻¹	ChemAxon
Polarizability	29.24 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

HMDB0030852

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

FDB002811

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

5748546

PDB ID

Not Available

ChEBI ID

133814

Good Scents ID

Not Available

References

General References

Zhang Y, Ling S, Fang Y, Zhu T, Gu Q, Zhu WM: Isolation, Structure elucidation, and antimycobacterial properties of dimeric naphtho-gamma-pyrones from the marine-derived fungus Aspergillus carbonarius. Chem Biodivers. 2008 Jan;5(1):93-100. doi: 10.1002/cbdv.200890017. [PubMed:18205129 ]
Siriwardane AM, Kumar NS, Jayasinghe L, Fujimoto Y: Chemical investigation of metabolites produced by an endophytic Aspergillus sp. isolated from Limonia acidissima. Nat Prod Res. 2015;29(14):1384-7. doi: 10.1080/14786419.2015.1025230. Epub 2015 Mar 26. [PubMed:25809933 ]
Bandara HM, Kumar NS, Jayasinghe L, Masubuti H, Fujimoto Y: A 3-Vinyl Cephem Derivative, a Useful Intermediate in the Synthesis of Cepham Antibiotics, from Aspergillus awamori Associated with Banana Fruit. Nat Prod Commun. 2015 Oct;10(10):1663-6. [PubMed:26669099 ]
Jorgensen TR, Nielsen KF, Arentshorst M, Park J, van den Hondel CA, Frisvad JC, Ram AF: Submerged conidiation and product formation by Aspergillus niger at low specific growth rates are affected in aerial developmental mutants. Appl Environ Microbiol. 2011 Aug;77(15):5270-7. doi: 10.1128/AEM.00118-11. Epub 2011 Jun 7. [PubMed:21652743 ]
Wu ZJ, Ouyang MA, Tan QW: New asperxanthone and asperbiphenyl from the marine fungus Aspergillus sp. Pest Manag Sci. 2009 Jan;65(1):60-5. doi: 10.1002/ps.1645. [PubMed:18823067 ]
Sakai K, Ohte S, Ohshiro T, Matsuda D, Masuma R, Rudel LL, Tomoda H: Selective inhibition of acyl-CoA:cholesterol acyltransferase 2 isozyme by flavasperone and sterigmatocystin from Aspergillus species. J Antibiot (Tokyo). 2008 Sep;61(9):568-72. doi: 10.1038/ja.2008.76. [PubMed:19160525 ]
Ehrlich KC, DeLucca AJ 2nd, Ciegler A: Naphtho-gamma-pyrone production by Aspergillus niger isolated from stored cottonseed. Appl Environ Microbiol. 1984 Jul;48(1):1-4. doi: 10.1128/aem.48.1.1-4.1984. [PubMed:6548104 ]

Showing NP-Card for Asperxanthone (NP0085148)

MOL for NP0085148 (Asperxanthone)

3D MOL for NP0085148 (Asperxanthone)

3D SDF for NP0085148 (Asperxanthone)

3D-SDF for NP0085148 (Asperxanthone)

PDB for NP0085148 (Asperxanthone)

3D PDB for NP0085148 (Asperxanthone)

SMILES for NP0085148 (Asperxanthone)

INCHI for NP0085148 (Asperxanthone)

Structure for NP0085148 (Asperxanthone)

3D Structure for NP0085148 (Asperxanthone)