Cyathin V (CHEBI:210096)

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CHEBI:210096 - Cyathin V

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ChEBI ID	CHEBI:210096
ChEBI Name	Cyathin V
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C20H32O5
Net Charge	0
Average Mass	352.471
Monoisotopic Mass	352.22497
SMILES	CC(C)C1=C2[C@H]3CC=C(CO)[C@@H](O)[C@H](O)[C@]3(C)CC[C@@]2(C)[C@H](O)[C@H]1O
InChI	InChI=1S/C20H32O5/c1-10(2)13-14-12-6-5-11(9-21)15(22)17(24)19(12,3)7-8-20(14,4)18(25)16(13)23/h5,10,12,15-18,21-25H,6-9H2,1-4H3/t12-,15-,16+,17+,18-,19-,20-/m1/s1
InChIKey	QHJHSSDSBVKONF-HPWGRUBNSA-N

Species of Metabolite	Component	Source	Comments
Cyathus africanus (ncbitaxon:380649)	-	PubMed (26022233)

ChEBI Ontology

Outgoing Relation(s)
	Cyathin V (CHEBI:210096) is a diterpenoid (CHEBI:23849)

IUPAC Name
(2S,3S,3aR,5aR,6R,7R,10aR)-8-(hydroxymethyl)-3a,5a-dimethyl-1-propan-2-yl-2,3,4,5,6,7,10,10a-octahydrocyclohepta[e]indene-2,3,6,7-tetrol

Manual Xrefs	Databases
78441301	ChemSpider