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Compounds

COMPOUND NPA002900

STRUCTURE

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PROJECT MOLECULE TO GLOBAL VIEW	See Global

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PROPERTIES

NPAID	NPA002900
CLUSTER ID	1151
NODE ID	984
NAME	Aspinotriol B
FORMULA	C9H16O3
MOLECULAR WEIGHT (Da)	172.2240
ACCURATE MASS (Da)	172.1099
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Aspergillus
ORIGIN SPECIES	ostianus
InChIKey	KWETYTFGFLMCQO-KSUZBYAFSA-N
InChI	InChI=1S/C9H16O3/c1-7(11)3-4-9(6-10)5-8(2)12/h3-5,7-8,10-12H,6H2,1-2H3/b4-3+,9-5-/t7-,8-/m0/s1
SMILES	C[C@@H](/C=C/C(=C/[C@H](C)O)/CO)O

ORIGINAL ISOLATION REFERENCE

CITATION	Kito, Keijiro; Ookura, Ryuhei; Yoshida, Sanae; Namikoshi, Michio; Ooi, Takashi; Kusumi, Takenori Pentaketides Relating to Aspinonene and Dihydroaspyrone from a Marine-Derived Fungus,Aspergillus ostianus Journal of Natural Products 2007 70 (12) 2022-2025.
DOI	10.1021/np070301n	PMID	17994702

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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