Chem
J-GLOBAL ID：200907028644928383   Nikkaji number：J561.802I

Unoprostone

ウノプロストン
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： C22H38O5
Molecular formula furigana： C22-H38-O5
Molecular weight： 382.541
InChI： InChI=1S/C22H38O5/c1-2-3-4-5-8-11-17(23)14-15-19-18(20(24)16-21(19)25)12-9-6-7-10-13-22(26)27/h6,9,18-21,24-25H,2-5,7-8,10-16H2,1H3,(H,26,27)/b9-6-/t18-,19-,20+,21-/m1/s1
InChI key： TVHAZVBUYQMHBC-SNHXEXRGSA-N
SMILES： CCCCCCCC(=O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O
Systematic name  (3)：
  • [Z,(+)]-7-[(1R,2R,3R,5S)-3,5-ジヒドロキシ-2-(3-オキソデシル)シクロペンチル]-5-ヘプテン酸
  • (5Z)-7-[(1R,2R,3R,5S)-3,5-ジヒドロキシ-2-(3-オキソデシル)シクロペンチル]ヘプタ-5-エン酸
  • (5Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-(3-oxodecyl)cyclopentyl]hept-5-enoic acid
Other name (3)：
  • ウノプロストン
  • Unoprostone
  • [Z,(+)]-7-[(1R,2R,3R,5S)-3,5-Dihydroxy-2-(3-oxodecyl)cyclopentyl]-5-heptenoic acid
CAS registry number： 120373-36-6
KEGG DRUG： D08661
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