8alpha,13R-Epoxy-14-labden-19-oic acid (CHEBI:175100)

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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	8alpha,13R-Epoxy-14-labden-19-oic acid

ChEBI ID	CHEBI:175100

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C20H32O3

Net Charge

Average Mass

320.473

Monoisotopic Mass

320.23514

InChI

InChI=1S/C20H32O3/c1-6-17(2)12-8-15-18(3)10-7-11-19(4,16(21)22)14(18)9-13-20(15,5)23-17/h6,14-15H,1,7-13H2,2-5H3,(H,21,22)

InChIKey

POQLUTMXUBSNEN-UHFFFAOYSA-N

SMILES

O1C2(C(C3(C(C(CCC3)(C)C(O)=O)CC2)C)CCC1(C)C=C)C

ChEBI Ontology
Outgoing	8alpha,13R-Epoxy-14-labden-19-oic acid (CHEBI:175100) is a triterpenoid (CHEBI:36615)

IUPAC Name

3-ethenyl-3,4a,7,10a-tetramethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[]chromene-7-carboxylic acid