Chem
J-GLOBAL ID：200907073811268990   Nikkaji number：J533.262A

CDB-2914

CDB-2914
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C30H37NO4
Molecular formula furigana： C30-H37-N-O4
Molecular weight： 475.629
InChI： InChI=1S/C30H37NO4/c1-18(32)30(35-19(2)33)15-14-27-25-12-8-21-16-23(34)11-13-24(21)28(25)26(17-29(27,30)3)20-6-9-22(10-7-20)31(4)5/h6-7,9-10,16,25-27H,8,11-15,17H2,1-5H3/t25-,26+,27-,29-,30-/m0/s1
InChI key： OOLLAFOLCSJHRE-ZHAKMVSLSA-N
SMILES： CN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@]2(OC(=O)C)C(=O)C)[C@@H]2CCC3=CC(=O)CCC3=C12
Systematic name  (7)：
  • 17α-アセトキシ-11β-[4-(ジメチルアミノ)フェニル]-19-ノルプレグナ-4,9-ジエン-3,20-ジオン
  • 11β-[4-(ジメチルアミノ)フェニル]-17-(アセチルオキシ)-19-ノルプレグナ-4,9-ジエン-3,20-ジオン
  • 11β-[4-(ジメチルアミノ)フェニル]-17α-アセトキシ-19-ノルプレグナ-4,9-ジエン-3,20-ジオン
  • 17β-アセチル-17-アセトキシ-11β-[4-(ジメチルアミノ)フェニル]エストラ-4,9-ジエン-3-オン
  • (17R)-11β-[4-(ジメチルアミノ)フェニル]-17-アセトキシ-19-ノルプレグナ-4,9-ジエン-3,20-ジオン
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Other name (14)：
  • 11β-[4-(Dimethylamino)phenyl]-17-(acetyloxy)-19-norpregna-4,9-diene-3,20-dione
  • HRP-2000
  • RU-3021-012
  • 11β-[4-(Dimethylamino)phenyl]-17α-acetoxy-19-norpregna-4,9-diene-3,20-dione
  • CDB-2914
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CAS registry number： 126784-99-4
Thsaurus map：
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