Chem
J-GLOBAL ID:200907059926572533   Nikkaji number:J2.258.660B

(25R)-26-(4-Methylpiperazino)furosta-5,20(22)-diene-3-one

(25R)-26-(4-メチルピペラジノ)フロスタ-5,20(22)-ジエン-3-オン
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: C32H50N2O2
Molecular formula furigana: C32-H50-N2-O2
Molecular weight: 494.764
InChI: InChI=1S/C32H50N2O2/c1-21(20-34-16-14-33(5)15-17-34)6-9-28-22(2)30-29(36-28)19-27-25-8-7-23-18-24(35)10-12-31(23,3)26(25)11-13-32(27,30)4/h7,21,25-27,29-30H,6,8-20H2,1-5H3/t21-,25-,26+,27+,29+,30+,31+,32+/m1/s1
InChI key: MPJRGGFIWTZJSE-JWSJBSCWSA-N
SMILES: C[C@H](CCC1=C(C)[C@H]2[C@H](C[C@H]3[C@@H]4CC=C5CC(=O)CC[C@]5(C)[C@H]4CC[C@]23C)O1)CN1CCN(C)CC1
Systematic name  (3):
  • (25R)-26-(4-メチルピペラジノ)フロスタ-5,20(22)-ジエン-3-オン
  • (1S,2S,4S,8S,9S,12S,13R)-7,9,13-トリメチル-6-[(3R)-3-メチル-4-(4-メチルピペラジン-1-イル)ブチル]-5-オキサペンタシクロ[10.8.0.02,9.04,8.013,18]イコサ-6,18-ジエン-16-オン
  • (1S,2S,4S,8S,9S,12S,13R)-7,9,13-trimethyl-6-[(3R)-3-methyl-4-(4-methylpiperazin-1-yl)butyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-6,18-dien-16-one
Other name (1):
  • (25R)-26-(4-Methylpiperazino)furosta-5,20(22)-diene-3-one
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