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Compounds

COMPOUND NPA010450

STRUCTURE

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PROPERTIES

NPAID	NPA010450
CLUSTER ID	63
NODE ID	59
NAME	Ustusolate D
FORMULA	C23H32O7
MOLECULAR WEIGHT (Da)	420.5020
ACCURATE MASS (Da)	420.2148
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Aspergillus
ORIGIN SPECIES	ustus 094102
InChIKey	IHLICQZFMFYTOA-ODJYOQRJSA-N
InChI	InChI=1S/C23H32O7/c1-21(2)11-8-12-22(3)19(21)16(13-15-14-29-20(25)23(15,22)26)30-17(24)9-6-7-10-18(27-4)28-5/h6-7,9-10,13,16,18-19,26H,8,11-12,14H2,1-5H3/b9-6+,10-7+/t16-,19+,22+,23+/m1/s1
SMILES	C[C@]12CCCC([C@@H]1[C@@H](C=C3[C@@]2(C(=O)OC3)O)OC(=O)/C=C/C=C/C(OC)OC)(C)C

ORIGINAL ISOLATION REFERENCE

CITATION	Lu, Zhenyu; Wang, Yi; Miao, Chengdu; Liu, Peipei; Hong, Kui; Zhu, Weiming Sesquiterpenoids and benzofuranoids from the marine-derived fungus Aspergillus ustus 094102. Journal of Natural Products 2009 72 (10) 1761-1767.
DOI	10.1021/np900268z	PMID	19769341

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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