Substance
  • Substance Name: abiraterone
  • Formula: C24H31NO
  • Molecular Weight: 349.5 g/mol
  • Identifiers:
    • inchi: InChI=1S/C24H31NO/c1-23-11-9-18(26)14-17(23)5-6-19-21-8-7-20(16-4-3-13-25-15-16)24(21,2)12-10-22(19)23/h3-5,7,13,15,18-19,21-22,26H,6,8-12,14H2,1-2H3/t18-,19-,21-,22-,23-,24+/m0/s1
    • inchikey: GZOSMCIZMLWJML-VJLLXTKPSA-N
    • casrn: 154229-19-3
    • csmiles: CC12CCC(CC1=CCC3C2CCC4(C3CC=C4C5=CN=CC=C5)C)O
    • ismiles: C[C@]12CC[C@@H](CC1=CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC=C4C5=CN=CC=C5)C)O
    • pubchemId: 132971
    • iupacname: (3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-pyridin-3-yl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-ol
    • wikidataId: Q321431
    • chemspiderId: 117349
    • dsstoxcmpId: DTXCID501021626
    • chemblId: CHEMBL254328
    • ecnumber: 810-941-6
abiraterone
Systems and Datasets