Chem
J-GLOBAL ID:200907017948505045   Nikkaji number:J1.190.947G

1-[[(1R,1α,5α,8R)-4-Oxo-6β-(hydroxymethyl)-3-oxabicyclo[3.2.1]octane-8-yl]carbonyl]-L-proline methyl ester

1-[[(1R,1α,5α,8R)-4-オキソ-6β-(ヒドロキシメチル)-3-オキサビシクロ[3.2.1]オクタン-8-イル]カルボニル]-L-プロリンメチル
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: C15H21NO6
Molecular formula furigana: C15-H21-N-O6
Molecular weight: 311.334
InChI: InChI=1S/C15H21NO6/c1-21-14(19)10-3-2-4-16(10)13(18)11-9-5-8(6-17)12(11)15(20)22-7-9/h8-12,17H,2-7H2,1H3/t8-,9+,10+,11-,12+/m1/s1
InChI key: YTVMUATWPYPILX-IIRVCBMXSA-N
SMILES: COC(=O)[C@@H]1CCCN1C(=O)[C@@H]1[C@H]2C[C@H](CO)[C@@H]1C(=O)OC2
Systematic name  (3):
  • 1-[[(1R,1α,5α,8R)-4-オキソ-6β-(ヒドロキシメチル)-3-オキサビシクロ[3.2.1]オクタン-8-イル]カルボニル]-L-プロリンメチル
  • メチル (2S)-1-[(1S,5R,7S,8R)-7-(ヒドロキシメチル)-2-オキソ-3-オキサビシクロ[3.2.1]オクタン-8-カルボニル]ピロリジン-2-カルボキシラート
  • methyl (2S)-1-[(1S,5R,7S,8R)-7-(hydroxymethyl)-2-oxo-3-oxabicyclo[3.2.1]octane-8-carbonyl]pyrrolidine-2-carboxylate
Other name (1):
  • 1-[[(1R,1α,5α,8R)-4-Oxo-6β-(hydroxymethyl)-3-oxabicyclo[3.2.1]octane-8-yl]carbonyl]-L-proline methyl ester
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