Chem
J-GLOBAL ID:200907092468775850   Nikkaji number:J1.865.972G

(5S,6R)-5,6-Epoxy-7-hydroxy-7-[(2S)-2-allyl-5-oxo-3-cyclopentenyl]heptanoic acid methyl ester

(5S,6R)-5,6-エポキシ-7-ヒドロキシ-7-[(2S)-2-アリル-5-オキソ-3-シクロペンテニル]ヘプタン酸メチル
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: C16H22O5
Molecular formula furigana: C16-H22-O5
Molecular weight: 294.347
InChI: InChI=1S/C16H22O5/c1-3-5-10-8-9-11(17)14(10)15(19)16-12(21-16)6-4-7-13(18)20-2/h3,8-10,12,14-16,19H,1,4-7H2,2H3/t10-,12-,14?,15?,16-/m0/s1
InChI key: ZCUGTEQHWUPJBK-JWIXTCODSA-N
SMILES: COC(=O)CCC[C@@H]1O[C@@H]1C(O)C1[C@@H](CC=C)C=CC1=O
Systematic name  (3):
  • (5S,6R)-5,6-エポキシ-7-ヒドロキシ-7-[(2S)-2-アリル-5-オキソ-3-シクロペンテニル]ヘプタン酸メチル
  • メチル 4-[(2S,3R)-3-{ヒドロキシ[(5S)-2-オキソ-5-(プロパ-2-エン-1-イル)シクロペンタ-3-エン-1-イル]メチル}オキシラン-2-イル]ブタノアート
  • methyl 4-[(2S,3R)-3-{hydroxy[(5S)-2-oxo-5-(prop-2-en-1-yl)cyclopent-3-en-1-yl]methyl}oxiran-2-yl]butanoate
Other name (1):
  • (5S,6R)-5,6-Epoxy-7-hydroxy-7-[(2S)-2-allyl-5-oxo-3-cyclopentenyl]heptanoic acid methyl ester
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