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Compounds

COMPOUND NPA002030

STRUCTURE

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PROPERTIES

NPAID	NPA002030
CLUSTER ID	151
NODE ID	143
NAME	(8E,12Z)‐10,11‐dihydroxyoctadeca‐8,12‐dienoic acid
FORMULA	C18H32O4
MOLECULAR WEIGHT (Da)	312.4500
ACCURATE MASS (Da)	312.2301
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Aspergillus
ORIGIN SPECIES	flavus
InChIKey	GJGSSMGEAZMVTN-FXYWYECCSA-N
InChI	InChI=1S/C18H32O4/c1-2-3-4-7-10-13-16(19)17(20)14-11-8-5-6-9-12-15-18(21)22/h10-11,13-14,16-17,19-20H,2-9,12,15H2,1H3,(H,21,22)/b13-10-,14-11+
SMILES	CCCCC/C=C\C(C(/C=C/CCCCCCC(=O)O)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Qiao, Ming-Feng; Ji, Nai-Yun; Miao, Feng-Ping; Yin, Xiu-Li Steroids and an oxylipin from an algicolous isolate of Aspergillus flavus Magnetic Resonance in Chemistry 2011 49 (6) 366-369.
DOI	10.1002/mrc.2748	PMID	21452344

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Eurotiomycetes	MycoBank	147545
Order	Eurotiales	MycoBank	5042
Family	Aspergillaceae	MycoBank	1131492
Genus	Aspergillus	MycoBank	5052

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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