Chem
J-GLOBAL ID：200907009684067688   Nikkaji number：J563.345A

(11β,13E)-11,16-Dihydroxy-16-methyl-9-oxoprost-13-en-1-oic acid

(11β,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
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： C21H36O5
Molecular formula furigana： C21-H36-O5
Molecular weight： 368.514
InChI： InChI=1S/C21H36O5/c1-3-4-13-21(2,26)14-9-11-17-16(18(22)15-19(17)23)10-7-5-6-8-12-20(24)25/h9,11,16-17,19,23,26H,3-8,10,12-15H2,1-2H3,(H,24,25)/b11-9+/t16-,17-,19+,21?/m1/s1
InChI key： CNWGPXZGIIOYDL-FXDASWSLSA-N
SMILES： CCCCC(C)(O)C/C=C/[C@H]1[C@@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O
Systematic name  (3)：
  • (11β,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
  • 7-[(1R,2R,3S)-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]ヘプタン酸
  • 7-[(1R,2R,3S)-3-hydroxy-2-[(1E)-4-hydroxy-4-methyloct-1-en-1-yl]-5-oxocyclopentyl]heptanoic acid
Other name (1)：
  • (11β,13E)-11,16-Dihydroxy-16-methyl-9-oxoprost-13-en-1-oic acid
Thsaurus map：
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