gamma-Taraxastane-3,20-diol (CHEBI:192059)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	gamma-Taraxastane-3,20-diol

ChEBI ID	CHEBI:192059

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C30H52O2

Net Charge

Average Mass

444.744

Monoisotopic Mass

444.39673

InChI

InChI=1S/C30H52O2/c1-19-24-20-9-10-22-27(5)13-12-23(31)25(2,3)21(27)11-14-29(22,7)28(20,6)17-15-26(24,4)16-18-30(19,8)32/h19-24,31-32H,9-18H2,1-8H3

InChIKey

FDNWHCZIHBJRLP-UHFFFAOYSA-N

SMILES

OC1(C(C2C3C(C4(C(C5(C(CC4)C(C(O)CC5)(C)C)C)CC3)C)(CCC2(CC1)C)C)C)C

Metabolite of Species	Details
Populus trichocarpa (NCBI:txid3694)	Found in root (BTO:0001188). See: MetaboLights Study

ChEBI Ontology
Outgoing	gamma-Taraxastane-3,20-diol (CHEBI:192059) is a triterpenoid (CHEBI:36615)

IUPAC Name

1,2,4a,6a,6b,9,9,12a-octamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a,14b-hexadecahydropicene-2,10-diol