[7-(2-hydroxypropan-2-yl)-4a-methyl-1-methylidene-2,3,4,5,6,7,8,8a-octahydronaphthalen-2-yl] acetate (CHEBI:181588)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

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	[7-(2-hydroxypropan-2-yl)-4a-methyl-1-methylidene-2,3,4,5,6,7,8,8a-octahydronaphthalen-2-yl] acetate

ChEBI ID	CHEBI:181588

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C17H28O3

Net Charge

Average Mass

280.408

Monoisotopic Mass

280.20384

InChI

InChI=1S/C17H28O3/c1-11-14-10-13(16(3,4)19)6-8-17(14,5)9-7-15(11)20-12(2)18/h13-15,19H,1,6-10H2,2-5H3

InChIKey

ZWIVVTOKXTZAOT-UHFFFAOYSA-N

SMILES

O(C1C(C2C(CCC(C2)C(O)(C)C)(CC1)C)=C)C(=O)C

ChEBI Ontology
Outgoing	[7-(2-hydroxypropan-2-yl)-4a-methyl-1-methylidene-2,3,4,5,6,7,8,8a-octahydronaphthalen-2-yl] acetate (CHEBI:181588) is a eudesmane sesquiterpenoid (CHEBI:62508)

IUPAC Name

[7-(2-hydroxypropan-2-yl)-4a-methyl-1-methylidene-2,3,4,5,6,7,8,8a-octahydronaphthalen-2-yl] acetate