CHEBI:232081 - 4α-hydroxy-5β-5,20-epoxytax-11-en-9-one

ChEBI IDCHEBI:232081
ChEBI Name4α-hydroxy-5β-5,20-epoxytax-11-en-9-one
Stars
ASCII Name4alpha-hydroxy-5beta-5,20-epoxytax-11-en-9-one
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC20H30O3
Net Charge0
Average Mass318.457
Monoisotopic Mass318.21949
SMILES[H][C@]12CCC(C)=C(CC(=O)[C@]3(C)CC[C@@]4([H])OC[C@@]4(O)[C@@]3([H])C1)C2(C)C
InChIInChI=1S/C20H30O3/c1-12-5-6-13-9-15-19(4,8-7-17-20(15,22)11-23-17)16(21)10-14(12)18(13,2)3/h13,15,17,22H,5-11H2,1-4H3/t13-,15-,17+,19+,20+/m0/s1
InChIKeyRPIBZLJIBKSODU-YFALUVIFSA-N
ChEBI Ontology
Outgoing Relation(s)
4α-hydroxy-5β-5,20-epoxytax-11-en-9-one (CHEBI:232081) is a oxetanes (CHEBI:38784)
4α-hydroxy-5β-5,20-epoxytax-11-en-9-one (CHEBI:232081) is a taxane diterpenoid (CHEBI:50367)
UniProt Name  Source
4α-hydroxy-5β-5,20-epoxytax-11-en-9-oneUniProt
Manual XrefsDatabases
CPD-26894MetaCyc
Citations