Fuscoporianol A (CHEBI:219056)

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CHEBI:219056 - Fuscoporianol A

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ChEBI ID	CHEBI:219056
ChEBI Name	Fuscoporianol A
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C31H52O3
Net Charge	0
Average Mass	472.754
Monoisotopic Mass	472.39165
SMILES	COC(C)(C)[C@@H]1CC[C@@H]([C@H]2CC[C@@]3(C)C4=C(CC[C@]23C)[C@@]2(C)CC[C@H](O)C(C)(C)C2CC4)[C@H]1O
InChI	InChI=1S/C31H52O3/c1-27(2)24-12-11-22-21(29(24,5)16-15-25(27)32)14-18-30(6)20(13-17-31(22,30)7)19-9-10-23(26(19)33)28(3,4)34-8/h19-20,23-26,32-33H,9-18H2,1-8H3/t19-,20+,23+,24?,25-,26+,29+,30+,31-/m0/s1
InChIKey	CJXWWUJWBXBUMK-CEEQJSQFSA-N

Species of Metabolite	Component	Source	Comments
Fuscoporia (ncbitaxon:175855)	-	PubMed (11355771)

ChEBI Ontology

Outgoing Relation(s)
	Fuscoporianol A (CHEBI:219056) is a triterpenoid (CHEBI:36615)

IUPAC Name
(3S,10S,13R,14R,17R)-17-[(1S,2R,3R)-2-hydroxy-3-(2-methoxypropan-2-yl)cyclopentyl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol