Substance
  • Substance Name: pregn-4-ene-3,20-dione, 16,17-epoxy-, (16alpha)-
  • Formula: C21H28O3
  • Molecular Weight: 328.4 g/mol
  • Identifiers:
    • casrn: 1097-51-4
    • pubchemId: 101966
    • inchi: InChI=1S/C21H28O3/c1-12(22)21-18(24-21)11-17-15-5-4-13-10-14(23)6-8-19(13,2)16(15)7-9-20(17,21)3/h10,15-18H,4-9,11H2,1-3H3/t15-,16+,17+,18-,19+,20+,21-/m1/s1
    • inchikey: LHNVKVKZPHUYQO-SRWWVFQWSA-N
    • csmiles: CC(=O)C12C(O1)CC3C2(CCC4C3CCC5=CC(=O)CCC45C)C
    • ismiles: CC(=O)[C@]12[C@H](O1)C[C@@H]3[C@@]2(CC[C@H]4[C@H]3CCC5=CC(=O)CC[C@]45C)C
    • iupacname: (1R,2S,4R,6S,7S,10S,11R)-6-acetyl-7,11-dimethyl-5-oxapentacyclo[8.8.0.02,7.04,6.011,16]octadec-15-en-14-one
    • wikidataId: Q27115861
    • chemspiderId: 92120
    • chemblId: CHEMBL2112759
    • ecnumber: 214-147-5
pregn-4-ene-3,20-dione, 16,17-epoxy-, (16alpha)-
Systems and Datasets