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Compounds

COMPOUND NPA019042

STRUCTURE

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PROJECT MOLECULE TO GLOBAL VIEW	See Global

EXTERNAL LINKS

PROPERTIES

NPAID	NPA019042
CLUSTER ID	46
NODE ID	11
NAME	Bis-7-O-8.8-O-7-zinniol
FORMULA	C30H40O6
MOLECULAR WEIGHT (Da)	496.6440
ACCURATE MASS (Da)	496.2825
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Alternaria
ORIGIN SPECIES	tagetica
InChIKey	NDXNIQMAPFLWAT-UHFFFAOYSA-N
InChI	InChI=1S/C30H40O6/c1-19(2)9-11-35-27-13-23-15-33-18-26-24(16-34-17-25(23)29(31-7)21(27)5)14-28(22(6)30(26)32-8)36-12-10-20(3)4/h9-10,13-14H,11-12,15-18H2,1-8H3
SMILES	CC1=C(C=C2COCC3=C(C(=C(C=C3COCC2=C1OC)OCC=C(C)C)C)OC)OCC=C(C)C

ORIGINAL ISOLATION REFERENCE

CITATION	Marcela Gamboa-Angulo; Alejos-Gonzalez, Fatima; Escalante-Erosa, Fabiola; Garcia-Sosa, Karlina; Delgado-Lamas, Guillermo; Pena-Rodriguez, Luis M. Novel dimeric metabolites from Alternaria tagetica Journal of Natural Products 2000 63 (8) 1117-1120.
DOI	10.1021/np990422q	PMID	10978208

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Dothideomycetes	MycoBank	147541
Order	Pleosporales	MycoBank	92860
Family	Pleosporaceae	MycoBank	28556
Genus	Alternaria	MycoBank	5598

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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