(3aS,3bR,5S,6aS,7aR)-2-hydroxy-3,3a,5-trimethyl-1-oxo-3b,4,6,6a,7,7a-hexahydrocyclopenta[a]pentalene-5-carboxylic acid (CHEBI:203831)

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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	(3aS,3bR,5S,6aS,7aR)-2-hydroxy-3,3a,5-trimethyl-1-oxo-3b,4,6,6a,7,7a-hexahydrocyclopenta[a]pentalene-5-carboxylic acid

ChEBI ID	CHEBI:203831

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C15H20O4

Net Charge

Average Mass

264.321

Monoisotopic Mass

264.13616

InChI

InChI=1S/C15H20O4/c1-7-11(16)12(17)9-4-8-5-14(2,13(18)19)6-10(8)15(7,9)3/h8-10,16H,4-6H2,1-3H3,(H,18,19)/t8-,9-,10+,14-,15+/m0/s1

InChIKey

BXFARSQJYWGLAG-UZGCMYEVSA-N

SMILES

O=C1C(O)=C(C)[C@@]2([C@H]1C[C@H]3C[C@@](C[C@@H]23)(C(=O)O)C)C

Metabolite of Species	Details
Stereum hirsutum (NCBI:txid40492)	See: PubMed

ChEBI Ontology
Outgoing	(3aS,3bR,5S,6aS,7aR)-2-hydroxy-3,3a,5-trimethyl-1-oxo-3b,4,6,6a,7,7a-hexahydrocyclopenta[a]pentalene-5-carboxylic acid (CHEBI:203831) is a sesquiterpenoid (CHEBI:26658)

IUPAC Name

(3aS,3bR,5S,6aS,7aR)-2-hydroxy-3,3a,5-trimethyl-1-oxo-3b,4,6,6a,7,7a-hexahydrocyclopenta[a]pentalene-5-carboxylic acid