Chem
J-GLOBAL ID:200907044413437188
Nikkaji number:J248.019K
ZK-98299
ZK-98299
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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:
C29 H39 NO3
Molecular formula furigana:
C29-H39-N-O3
Molecular weight:
449.635
InChI:
InChI=1S/C29H39NO3/c1-28-18-25(19-5-8-21(9-6-19)30(2)3)27-23-12-10-22(32)17-20(23)7-11-24(27)26(28)13-15-29(28,33)14-4-16-31/h5-6,8-9,17,24-26,31,33H,4,7,10-16,18H2,1-3H3/t24-,25+,26-,28+,29+/m0/s1
InChI key:
IEXUMDBQLIVNHZ-YOUGDJEHSA-N
SMILES:
CN(C)c1ccc(cc1)[C@H]1C[C@]2(C)[C@@H](CC[C@]2(O)CCCO)[C@@H]2CCC3=CC(=O)CCC3=C12
Systematic name (3):
(13α)-11β-[4-(ジメチルアミノ)フェニル]-17α-ヒドロキシ-17β-(3-ヒドロキシプロピル)エストラ-4,9-ジエン-3-オン
(1S,3aS,3bS,10R,11aR)-10-[4-(ジメチルアミノ)フェニル]-1-ヒドロキシ-1-(3-ヒドロキシプロピル)-11a-メチル-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,10H,11H,11aH-シクロペンタ[a]フェナントレン-7-オン
(1S,3aS,3bS,10R,11aR)-10-[4-(dimethylamino)phenyl]-1-hydroxy-1-(3-hydroxypropyl)-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
Other name (5):
Onapristone
ZK-98299
オナプリストン
(13α)-11β-[4-(Dimethylamino)phenyl]-17α-hydroxy-17β-(3-hydroxypropyl)estra-4,9-dien-3-one
ZK-299
CAS registry number:
96346-61-1
Application (1):
antihormone
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