CHEBI:136364 - 13-methyl-4,4-bisnorpodocarpa-8,11,13-trien-3-one

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ChEBI Name 13-methyl-4,4-bisnorpodocarpa-8,11,13-trien-3-one
ChEBI ID CHEBI:136364
Definition A tricyclic diterpenoidthat is 4a,7-dimethyl-3,4,4a,9,10,10a-hexahydrophenanthrene in which the methylene hydrogens at position 2 have been replaced by an oxo group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C16H20O
Net Charge 0
Average Mass 228.330
Monoisotopic Mass 228.15142
InChI InChI=1S/C16H20O/c1-11-3-6-15-12(9-11)4-5-13-10-14(17)7-8-16(13,15)2/h3,6,9,13H,4-5,7-8,10H2,1-2H3/t13-,16-/m0/s1
InChIKey JZECOIINDLDHBV-BBRMVZONSA-N
SMILES O=C1C[C@]2([C@](CC1)(C3=C(CC2)C=C(C=C3)C)C)[H]
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) See: MetaboLights Study
Homo sapiens (NCBI:txid9606) See: PubMed
Roles Classification
Biological Role(s): human xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 13-methyl-4,4-bisnorpodocarpa-8,11,13-trien-3-one (CHEBI:136364) has role human xenobiotic metabolite (CHEBI:76967)
13-methyl-4,4-bisnorpodocarpa-8,11,13-trien-3-one (CHEBI:136364) is a carbotricyclic compound (CHEBI:38032)
13-methyl-4,4-bisnorpodocarpa-8,11,13-trien-3-one (CHEBI:136364) is a cyclic terpene ketone (CHEBI:36130)
13-methyl-4,4-bisnorpodocarpa-8,11,13-trien-3-one (CHEBI:136364) is a tricyclic diterpenoid (CHEBI:79084)
IUPAC Name
(4aS,10aS)-4a,7-dimethyl-3,4,4a,9,10,10a-hexahydrophenanthren-2(1H)-one
Synonym Source
13-methyl-4,4-bisnor-8,11,13-podocarpatrien-3-one ChEBI
Last Modified
18 January 2018