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Compounds

COMPOUND NPA012496

STRUCTURE

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PROPERTIES

NPAID	NPA012496
CLUSTER ID	313
NODE ID	284
NAME	2,3-didehydro-19α-hydroxy-14-epicochlioquinone B
FORMULA	C28H38O7
MOLECULAR WEIGHT (Da)	486.6050
ACCURATE MASS (Da)	486.2618
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Nigrospora
ORIGIN SPECIES	sp. MA75
InChIKey	GWQYUHGJJNBHJP-RLGURTFRSA-N
InChI	InChI=1S/C28H38O7/c1-8-14(2)23(31)15(3)16-11-18(29)17-12-19-27(6,35-25(17)24(16)32)10-9-21-28(19,7)20(30)13-22(34-21)26(4,5)33/h8,11,15,19-22,30,33H,9-10,12-13H2,1-7H3/b14-8+/t15-,19-,20-,21+,22+,27-,28-/m0/s1
SMILES	C/C=C(\C)/C(=O)[C@@H](C)C1=CC(=O)C2=C(C1=O)O[C@]3(CC[C@@H]4[C@@]([C@H]3C2)([C@H](C[C@@H](O4)C(C)(C)O)O)C)C

ORIGINAL ISOLATION REFERENCE

CITATION	Shang, Zhuo; Li, Xiao-Ming; Li, Chun-Shun; Wang, Bin-Gui Diverse Secondary Metabolites Produced by Marine-Derived Fungus Nigrospora sp. MA75 on Various Culture Media Chemistry and Biodiversity 2012 9 (7) 1338-1348.
DOI	10.1002/cbdv.201100216	PMID	22782879

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Sordariomycetes	MycoBank	147550
Order	Xylariales	MycoBank	37989
Family	Apiosporaceae	MycoBank	106263
Genus	Nigrospora	MycoBank	114230

CLASSYFIRE

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DESCRIPTION	[[ getValue('description') ]]
KINGDOM	[[ getValue('kingdom') ]]
SUPER CLASS	[[ getValue('superclass') ]]
CLASS	[[ getValue('class') ]]
SUB CLASS	[[ getValue('subclass') ]]
MOLECULAR FRAMEWORK	[[ getValue('molecular_framework') ]]

NP CLASSIFIER

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SUPER CLASS	[[ getValue('superclass_results') ]]
CLASS	[[ getValue('class_results') ]]
PATHWAY	[[ getValue('pathway_results') ]]
IS GLYCOSIDE?	[[ getValue('isglycoside') ]]

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