6beta,11,12-trihydroxytremul-1(10)-ene (CHEBI:202696)

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CHEBI:202696 - 6beta,11,12-trihydroxytremul-1(10)-ene

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ChEBI ID	CHEBI:202696
ChEBI Name	6beta,11,12-trihydroxytremul-1(10)-ene
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C15H26O3
Net Charge	0
Average Mass	254.370
Monoisotopic Mass	254.18819
SMILES	CC1(C)C=C2[C@@H](CO)[C@@H](CO)CC[C@@](C)(O)[C@@H]2C1
InChI	InChI=1S/C15H26O3/c1-14(2)6-11-12(9-17)10(8-16)4-5-15(3,18)13(11)7-14/h6,10,12-13,16-18H,4-5,7-9H2,1-3H3/t10-,12+,13-,15-/m1/s1
InChIKey	JBCTUOAHMOVMOD-CQROYNQRSA-N

Species of Metabolite	Component	Source	Comments
Phellinus igniarius (ncbitaxon:40472)	-	PubMed (10598029)

ChEBI Ontology

Outgoing Relation(s)
	6beta,11,12-trihydroxytremul-1(10)-ene (CHEBI:202696) is a tertiary alcohol (CHEBI:26878)

IUPAC Name
(3aR,4R,7S,8S)-7,8-bis(hydroxymethyl)-2,2,4-trimethyl-3,3a,5,6,7,8-hexahydroazulen-4-ol

Manual Xrefs	Databases
78442296	ChemSpider