Chem
J-GLOBAL ID:200907066375863732   Nikkaji number:J1.836.820J

(5Z,9S,11R,13E)-9,11,15-Trihydroxy-16-[3-(trifluoromethyl)phenoxy]-17,18,19,20-tetranor-5,13-prostadiene-1-oic acid

(5Z,9S,11R,13E)-9,11,15-トリヒドロキシ-16-[3-(トリフルオロメチル)フェノキシ]-17,18,19,20-テトラノル-5,13-プロスタジエン-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: C23H29F3O6
Molecular formula furigana: C23-H29-F3-O6
Molecular weight: 458.474
InChI: InChI=1S/C23H29F3O6/c24-23(25,26)15-6-5-7-17(12-15)32-14-16(27)10-11-19-18(20(28)13-21(19)29)8-3-1-2-4-9-22(30)31/h1,3,5-7,10-12,16,18-21,27-29H,2,4,8-9,13-14H2,(H,30,31)/b3-1-,11-10+/t16?,18-,19-,20+,21-/m1/s1
InChI key: WWSWYXNVCBLWNZ-RNZMLZMWSA-N
SMILES: OC(COc1cccc(c1)C(F)(F)F)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O
Systematic name  (3):
  • (5Z,9S,11R,13E)-9,11,15-トリヒドロキシ-16-[3-(トリフルオロメチル)フェノキシ]-17,18,19,20-テトラノル-5,13-プロスタジエン-1-酸
  • (5Z)-7-[(1R,2R,3R,5S)-3,5-ジヒドロキシ-2-[(1E)-3-ヒドロキシ-4-[3-(トリフルオロメチル)フェノキシ]ブタ-1-エン-1-イル]シクロペンチル]ヘプタ-5-エン酸
  • (5Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(1E)-3-hydroxy-4-[3-(trifluoromethyl)phenoxy]but-1-en-1-yl]cyclopentyl]hept-5-enoic acid
Other name (1):
  • (5Z,9S,11R,13E)-9,11,15-Trihydroxy-16-[3-(trifluoromethyl)phenoxy]-17,18,19,20-tetranor-5,13-prostadiene-1-oic acid
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