Chem
J-GLOBAL ID:200907011364953358   Nikkaji number:J635.414I

(Z)-7-[(1R)-2β-[(1E,3R)-3-Hydroxy-5-(3-bromophenyl)-1-pentenyl]-3α,5α-dihydroxycyclopentan-1α-yl]-5-heptenoic acid isopropyl ester

(Z)-7-[(1R)-2β-[(1E,3R)-3-ヒドロキシ-5-(3-ブロモフェニル)-1-ペンテニル]-3α,5α-ジヒドロキシシクロペンタン-1α-イル]-5-ヘプテン酸イソプロピル
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: C26H37BrO5
Molecular formula furigana: C26-H37-BR-O5
Molecular weight: 509.481
InChI: InChI=1S/C26H37BrO5/c1-18(2)32-26(31)11-6-4-3-5-10-22-23(25(30)17-24(22)29)15-14-21(28)13-12-19-8-7-9-20(27)16-19/h3,5,7-9,14-16,18,21-25,28-30H,4,6,10-13,17H2,1-2H3/b5-3-,15-14+/t21-,22-,23-,24+,25-/m1/s1
InChI key: VGDUBFZGFSYEKB-BMBLLYGXSA-N
SMILES: CC(C)OC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@H](O)CCc1cccc(Br)c1
Systematic name  (3):
  • (Z)-7-[(1R)-2β-[(1E,3R)-3-ヒドロキシ-5-(3-ブロモフェニル)-1-ペンテニル]-3α,5α-ジヒドロキシシクロペンタン-1α-イル]-5-ヘプテン酸イソプロピル
  • プロパン-2-イル (5Z)-7-[(1R,2R,3R,5S)-2-[(1E,3R)-5-(3-ブロモフェニル)-3-ヒドロキシペンタ-1-エン-1-イル]-3,5-ジヒドロキシシクロペンチル]ヘプタ-5-エノアート
  • propan-2-yl (5Z)-7-[(1R,2R,3R,5S)-2-[(1E,3R)-5-(3-bromophenyl)-3-hydroxypent-1-en-1-yl]-3,5-dihydroxycyclopentyl]hept-5-enoate
Other name (1):
  • (Z)-7-[(1R)-2β-[(1E,3R)-3-Hydroxy-5-(3-bromophenyl)-1-pentenyl]-3α,5α-dihydroxycyclopentan-1α-yl]-5-heptenoic acid isopropyl ester
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