CHEBI:230000 - 8alpha-8-Hydroxy-12-oxo-13-abieten-18-oic acid

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ChEBI Name 8alpha-8-Hydroxy-12-oxo-13-abieten-18-oic acid
ChEBI ID CHEBI:230000
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H30O4
Net Charge 0
Average Mass 334.456
Monoisotopic Mass 334.21441
InChI InChI=1S/C20H30O4/c1-12(2)13-11-20(24)9-6-15-18(3,16(20)10-14(13)21)7-5-8-19(15,4)17(22)23/h11-12,15-16,24H,5-10H2,1-4H3,(H,22,23)
InChIKey BDGVLOCEQIJJDJ-UHFFFAOYSA-N
SMILES OC12C(C3(C(C(CCC3)(C)C(O)=O)CC1)C)CC(=O)C(=C2)C(C)C
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in feces (BTO:0000440). See: MetaboLights Study
ChEBI Ontology
Outgoing 8alpha-8-Hydroxy-12-oxo-13-abieten-18-oic acid (CHEBI:230000) is a diterpenoid (CHEBI:23849)
IUPAC Name
8a-hydroxy-1,4a-dimethyl-6-oxo-7-propan-2-yl-2,3,4,4b,5,9,10,10a-octahydrophenanthrene-1-carboxylic acid
Manual Xrefs Databases
214578 ChemSpider
HMDB0035878 HMDB
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