Chem
J-GLOBAL ID:200907049694592278   Nikkaji number:J1.880.229E

(6α)-2α-[(4R,5R)-5-[(4R)-2,2-Dimethyl-1,3-dioxolane-4-yl]-2,2-dimethyl-1,3-dioxolane-4-yl]-4β-phenyl-3α,5α-dihydroxy-7β-methoxy-1-azabicyclo[4.2.0]octane-8-one

(6α)-2α-[(4R,5R)-5-[(4R)-2,2-ジメチル-1,3-ジオキソラン-4-イル]-2,2-ジメチル-1,3-ジオキソラン-4-イル]-4β-フェニル-3α,5α-ジヒドロキシ-7β-メトキシ-1-アザビシクロ[4.2.0]オクタン-8-オン
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: C24H33NO8
Molecular formula furigana: C24-H33-N-O8
Molecular weight: 463.527
InChI: InChI=1S/C24H33NO8/c1-23(2)30-11-13(31-23)19-20(33-24(3,4)32-19)15-17(26)14(12-9-7-6-8-10-12)18(27)16-21(29-5)22(28)25(15)16/h6-10,13-21,26-27H,11H2,1-5H3/t13-,14-,15+,16+,17-,18+,19+,20-,21-/m1/s1
InChI key: AOZQQQDDSFYVMF-QJEBQUJDSA-N
SMILES: CO[C@@H]1[C@@H]2[C@@H](O)[C@@H]([C@@H](O)[C@@H]([C@H]3OC(C)(C)O[C@H]3[C@H]3COC(C)(C)O3)N2C1=O)c1ccccc1
Systematic name  (3):
  • (6α)-2α-[(4R,5R)-5-[(4R)-2,2-ジメチル-1,3-ジオキソラン-4-イル]-2,2-ジメチル-1,3-ジオキソラン-4-イル]-4β-フェニル-3α,5α-ジヒドロキシ-7β-メトキシ-1-アザビシクロ[4.2.0]オクタン-8-オン
  • (2S,3R,4R,5S,6S,7R)-2-[(4R,5R)-5-[(4R)-2,2-ジメチル-1,3-ジオキソラン-4-イル]-2,2-ジメチル-1,3-ジオキソラン-4-イル]-3,5-ジヒドロキシ-7-メトキシ-4-フェニル-1-アザビシクロ[4.2.0]オクタン-8-オン
  • (2S,3R,4R,5S,6S,7R)-2-[(4R,5R)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-1,3-dioxolan-4-yl]-3,5-dihydroxy-7-methoxy-4-phenyl-1-azabicyclo[4.2.0]octan-8-one
Other name (1):
  • (6α)-2α-[(4R,5R)-5-[(4R)-2,2-Dimethyl-1,3-dioxolane-4-yl]-2,2-dimethyl-1,3-dioxolane-4-yl]-4β-phenyl-3α,5α-dihydroxy-7β-methoxy-1-azabicyclo[4.2.0]octane-8-one
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