Chem
J-GLOBAL ID：200907056244514834   Nikkaji number：J22.802H

Butaprost

ブタプロスト
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： C24H40O5
Molecular formula furigana： C24-H40-O5
Molecular weight： 408.579
InChI： InChI=1S/C24H40O5/c1-3-14-24(15-9-16-24)22(27)12-8-11-19-18(20(25)17-21(19)26)10-6-4-5-7-13-23(28)29-2/h8,11,18-19,21-22,26-27H,3-7,9-10,12-17H2,1-2H3/b11-8+/t18-,19-,21-,22-/m1/s1
InChI key： XRISENIKJUKIHD-LHQZMKCDSA-N
SMILES： CCCC1(CCC1)[C@H](O)C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC
Systematic name  (3)：
  • (1R)-3α-ヒドロキシ-2β-[(1E,4R)-4-ヒドロキシ-4-(1-プロピルシクロブタン-1-イル)-1-ブテニル]-5-オキソシクロペンタンヘプタン酸メチル
  • メチル 7-[(1R,2R,3R)-3-ヒドロキシ-2-[(1E,4R)-4-ヒドロキシ-4-(1-プロピルシクロブチル)ブタ-1-エン-1-イル]-5-オキソシクロペンチル]ヘプタノアート
  • methyl 7-[(1R,2R,3R)-3-hydroxy-2-[(1E,4R)-4-hydroxy-4-(1-propylcyclobutyl)but-1-en-1-yl]-5-oxocyclopentyl]heptanoate
Other name (5)：
  • ブタプロスト
  • Butaprost
  • (1R)-3α-Hydroxy-2β-[(1E,4R)-4-hydroxy-4-(1-propylcyclobutan-1-yl)-1-butenyl]-5-oxocyclopentaneheptanoic acid methyl ester
  • BAY-q-4218
  • TR-4979
CAS registry number： 69648-38-0
KEGG DRUG： D03187
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