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Compounds

COMPOUND NPA005161

STRUCTURE

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PROPERTIES

NPAID	NPA005161
CLUSTER ID	313
NODE ID	284
NAME	Stemphone
FORMULA	C30H42O8
MOLECULAR WEIGHT (Da)	530.6580
ACCURATE MASS (Da)	530.2880
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Stemphylium
ORIGIN SPECIES	sarcinaeforrne
InChIKey	CGFWCZMBHASRBJ-CCZFOCGKSA-N
InChI	InChI=1S/C30H42O8/c1-9-15(2)25(36-17(4)31)16(3)18-14-19(32)22-24(34)27-29(7)12-10-20(28(5,6)35)37-21(29)11-13-30(27,8)38-26(22)23(18)33/h9,14,16,20-21,24-25,27,34-35H,10-13H2,1-8H3/b15-9+/t16-,20+,21+,24+,25+,27+,29-,30+/m0/s1
SMILES	C/C=C(\C)/[C@H]([C@@H](C)C1=CC(=O)C2=C(C1=O)O[C@@]3(CC[C@@H]4[C@@]([C@H]3[C@@H]2O)(CC[C@@H](O4)C(C)(C)O)C)C)OC(=O)C

ORIGINAL ISOLATION REFERENCE

CITATION	Huber, CAROL SAUNDERSON The structure of stemphone, a yellow fungal metabolite Acta Crystallographica Section B: Structural Science 1975 31 (1) 108-113.
DOI	10.1107/s056774087500218x	PMID	-

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	Stemphylium	MycoBank	95729

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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