Chem
J-GLOBAL ID:200907090285299062   Nikkaji number:J238.397G

(Z)-7-[(1β)-3β,5β-Dihydroxy-2α-[(3S,1E)-3-hydroxy-4-[3-(trifluoromethyl)phenoxy]-1-butenyl]cyclopentyl]-5-heptenoic acid

(Z)-7-[(1β)-3β,5β-ジヒドロキシ-2α-[(3S,1E)-3-ヒドロキシ-4-[3-(トリフルオロメチル)フェノキシ]-1-ブテニル]シクロペンチル]-5-ヘプテン酸
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-/m0/s1
InChI key: WWSWYXNVCBLWNZ-CHPNCWRZSA-N
SMILES: O[C@H](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  (4):
  • (Z)-7-[(1β)-3β,5β-ジヒドロキシ-2α-[(3S,1E)-3-ヒドロキシ-4-[3-(トリフルオロメチル)フェノキシ]-1-ブテニル]シクロペンチル]-5-ヘプテン酸
  • (Z)-7-[(1β,2α,3β,5β)-3,5-ジヒドロキシ-2-[(3S,1E)-3-ヒドロキシ-4-[3-(トリフルオロメチル)フェノキシ]-1-ブテニル]シクロペンチル]-5-ヘプテン酸
  • (5Z)-7-[(1S,2S,3S,5R)-3,5-ジヒドロキシ-2-[(1E,3S)-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-[(1S,2S,3S,5R)-3,5-dihydroxy-2-[(1E,3S)-3-hydroxy-4-[3-(trifluoromethyl)phenoxy]but-1-en-1-yl]cyclopentyl]hept-5-enoic acid
Other name (2):
  • (Z)-7-[(1β)-3β,5β-Dihydroxy-2α-[(3S,1E)-3-hydroxy-4-[3-(trifluoromethyl)phenoxy]-1-butenyl]cyclopentyl]-5-heptenoic acid
  • (Z)-7-[(1β,2α,3β,5β)-3,5-Dihydroxy-2-[(3S,1E)-3-hydroxy-4-[3-(trifluoromethyl)phenoxy]-1-butenyl]cyclopentyl]-5-heptenoic acid
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