(+)-(3S,6S,7S,10S)-tremul-1-ene-10,11,12-triol (CHEBI:207910)

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CHEBI:207910 - (+)-(3S,6S,7S,10S)-tremul-1-ene-10,11,12-triol

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ChEBI ID	CHEBI:207910
ChEBI Name	(+)-(3S,6S,7S,10S)-tremul-1-ene-10,11,12-triol
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Submitter	MetaboLights
Downloads	Molfile

Formula	C15H26O3
Net Charge	0
Average Mass	254.370
Monoisotopic Mass	254.18819
SMILES	C[C@H]1CC[C@H](CO)C(CO)=C2[C@H]1CC(C)(C)[C@@H]2O
InChI	InChI=1S/C15H26O3/c1-9-4-5-10(7-16)12(8-17)13-11(9)6-15(2,3)14(13)18/h9-11,14,16-18H,4-8H2,1-3H3/t9-,10+,11-,14+/m0/s1
InChIKey	VAKGCQGAOMIBKI-BBGACYKPSA-N

Species of Metabolite	Component	Source	Comments
Phellinus igniarius (ncbitaxon:40472)	-	PubMed (20583752)

ChEBI Ontology

Outgoing Relation(s)
	(+)-(3S,6S,7S,10S)-tremul-1-ene-10,11,12-triol (CHEBI:207910) is a organic hydroxy compound (CHEBI:33822)

IUPAC Name
(1S,3aS,4S,7S)-7,8-bis(hydroxymethyl)-2,2,4-trimethyl-3,3a,4,5,6,7-hexahydro-1H-azulen-1-ol

Manual Xrefs	Databases
78437344	ChemSpider