Fomitellic acid A (CHEBI:218876)

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CHEBI:218876 - Fomitellic acid A

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ChEBI ID	CHEBI:218876
ChEBI Name	Fomitellic acid A
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C30H46O6
Net Charge	0
Average Mass	502.692
Monoisotopic Mass	502.32944
SMILES	CC(C)=CCCC(C)[C@H]1CC[C@@]2(C)C3=C([C@H](O)C[C@]12C)[C@@]1(C)[C@H](O)C[C@H](O)C(C)(C(=O)O)[C@@H]1CC3=O
InChI	InChI=1S/C30H46O6/c1-16(2)9-8-10-17(3)18-11-12-27(4)24-19(31)13-21-29(6,25(24)20(32)15-28(18,27)5)22(33)14-23(34)30(21,7)26(35)36/h9,17-18,20-23,32-34H,8,10-15H2,1-7H3,(H,35,36)/t17?,18-,20-,21-,22-,23+,27+,28-,29-,30?/m1/s1
InChIKey	KDPKGPAHQJHMQT-DAEAPZEHSA-N

Species of Metabolite	Component	Source	Comments
Perenniporia fraxinea (ncbitaxon:1350006)	-	PubMed (9514006)

ChEBI Ontology

Outgoing Relation(s)
	Fomitellic acid A (CHEBI:218876) is a triterpenoid (CHEBI:36615)

IUPAC Name
(1R,3S,5R,10S,11R,13R,14R,17R)-1,3,11-trihydroxy-4,10,13,14-tetramethyl-17-(6-methylhept-5-en-2-yl)-7-oxo-1,2,3,5,6,11,12,15,16,17-decahydrocyclopenta[a]phenanthrene-4-carboxylic acid

Manual Xrefs	Databases
8872160	ChemSpider