Chem
J-GLOBAL ID:200907042022725984   Nikkaji number:J352.975D

(4Z)-7-[(1R,2R,3R)-3α-Hydroxy-2β-[(1E,4R)-6-(1-cyclopentenyl)-4-hydroxy-4-methyl-1-hexen-5-ynyl]-5-oxocyclopentan-1α-yl]-4-heptenoic acid methyl ester

(4Z)-7-[(1R,2R,3R)-3α-ヒドロキシ-2β-[(1E,4R)-6-(1-シクロペンテニル)-4-ヒドロキシ-4-メチル-1-ヘキセン-5-イニル]-5-オキソシクロペンタン-1α-イル]-4-ヘプテン酸メチル
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: C25H34O5
Molecular formula furigana: C25-H34-O5
Molecular weight: 414.542
InChI: InChI=1S/C25H34O5/c1-25(29,17-15-19-10-7-8-11-19)16-9-13-21-20(22(26)18-23(21)27)12-5-3-4-6-14-24(28)30-2/h3-4,9-10,13,20-21,23,27,29H,5-8,11-12,14,16,18H2,1-2H3/b4-3-,13-9+/t20-,21-,23-,25-/m1/s1
InChI key: RAMJBAWLPVTQBD-MDBHBZJLSA-N
SMILES: COC(=O)CC/C=C\CC[C@@H]1[C@@H](/C=C/C[C@@](C)(O)C#CC2=CCCC2)[C@H](O)CC1=O
Systematic name  (3):
  • (4Z)-7-[(1R,2R,3R)-3α-ヒドロキシ-2β-[(1E,4R)-6-(1-シクロペンテニル)-4-ヒドロキシ-4-メチル-1-ヘキセン-5-イニル]-5-オキソシクロペンタン-1α-イル]-4-ヘプテン酸メチル
  • メチル (4Z)-7-[(1R,2R,3R)-2-[(1E,4R)-6-(シクロペンタ-1-エン-1-イル)-4-ヒドロキシ-4-メチルヘキサ-1-エン-5-イン-1-イル]-3-ヒドロキシ-5-オキソシクロペンチル]ヘプタ-4-エノアート
  • methyl (4Z)-7-[(1R,2R,3R)-2-[(1E,4R)-6-(cyclopent-1-en-1-yl)-4-hydroxy-4-methylhex-1-en-5-yn-1-yl]-3-hydroxy-5-oxocyclopentyl]hept-4-enoate
Other name (1):
  • (4Z)-7-[(1R,2R,3R)-3α-Hydroxy-2β-[(1E,4R)-6-(1-cyclopentenyl)-4-hydroxy-4-methyl-1-hexen-5-ynyl]-5-oxocyclopentan-1α-yl]-4-heptenoic acid methyl ester
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