Chem
J-GLOBAL ID：200907054905334622   Nikkaji number：J345.358H

(11α,13E)-11,16-Dihydroxy-16-methyl-9-oxoprosta-13-ene-1-oic acid methyl ester

(11α,13E)-11,16-ジヒドロキシ-16-メチル-9-オキソプロスタ-13-エン-1-酸メチル
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/c1-4-5-14-22(2,26)15-10-12-18-17(19(23)16-20(18)24)11-8-6-7-9-13-21(25)27-3/h10,12,17-18,20,24,26H,4-9,11,13-16H2,1-3H3/b12-10+/t17-,18-,20-,22?/m1/s1
InChI key： OJLOPKGSLYJEMD-URPKTTJQSA-N
SMILES： CCCCC(C)(O)C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC
Systematic name  (3)：
  • (11α,13E)-11,16-ジヒドロキシ-16-メチル-9-オキソプロスタ-13-エン-1-酸メチル
  • メチル 7-[(1R,2R,3R)-3-ヒドロキシ-2-[(1E)-4-ヒドロキシ-4-メチルオクタ-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)-4-hydroxy-4-methyloct-1-en-1-yl]-5-oxocyclopentyl]heptanoate
Other name (1)：
  • (11α,13E)-11,16-Dihydroxy-16-methyl-9-oxoprosta-13-ene-1-oic acid methyl ester
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