Chem
J-GLOBAL ID:200907034776710166   Nikkaji number:J1.479.972I

(4S,5R)-4-Methyl-5-hydroxy-6-(4-methoxybenzyloxy)-2-hexenoic acid methyl ester

(4S,5R)-4-メチル-5-ヒドロキシ-6-(4-メトキシベンジルオキシ)-2-ヘキセン酸メチル
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/c1-12(4-9-16(18)20-3)15(17)11-21-10-13-5-7-14(19-2)8-6-13/h4-9,12,15,17H,10-11H2,1-3H3/t12-,15-/m0/s1
InChI key: KQRJJDSSNNYTDH-WFASDCNBSA-N
SMILES: COC(=O)C=C[C@H](C)[C@@H](O)COCc1ccc(OC)cc1
Systematic name  (4):
  • (4S,5R)-6-(4-メトキシベンジルオキシ)-5-ヒドロキシ-4-メチル-2-ヘキセン酸メチル
  • (4S,5R)-4-メチル-5-ヒドロキシ-6-(4-メトキシベンジルオキシ)-2-ヘキセン酸メチル
  • メチル (4S,5R)-5-ヒドロキシ-6-[(4-メトキシフェニル)メトキシ]-4-メチルヘキサ-2-エノアート
  • methyl (4S,5R)-5-hydroxy-6-[(4-methoxyphenyl)methoxy]-4-methylhex-2-enoate
Other name (2):
  • (4S,5R)-6-(4-Methoxybenzyloxy)-5-hydroxy-4-methyl-2-hexenoic acid methyl ester
  • (4S,5R)-4-Methyl-5-hydroxy-6-(4-methoxybenzyloxy)-2-hexenoic acid methyl ester
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