Chem
J-GLOBAL ID：200907004537788211   Nikkaji number：J2.133.954G

Bisbenzoic acid (5R)-2-(acetylamino)-5α-[(benzoyloxy)methyl]-6,7-dihydro-5H-pyrano[3,2-d]thiazole-6β,7α-diyl ester

ビス安息香酸(5R)-2-(アセチルアミノ)-5α-[(ベンゾイルオキシ)メチル]-6,7-ジヒドロ-5H-ピラノ[3,2-d]チアゾール-6β,7α-ジイル
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： C30H24N2O8S
Molecular formula furigana： C30-H24-N2-O8-S
Molecular weight： 572.590
InChI： InChI=1S/C30H24N2O8S/c1-18(33)31-30-32-23-25(40-28(36)21-15-9-4-10-16-21)24(39-27(35)20-13-7-3-8-14-20)22(38-29(23)41-30)17-37-26(34)19-11-5-2-6-12-19/h2-16,22,24-25H,17H2,1H3,(H,31,32,33)/t22-,24-,25-/m1/s1
InChI key： IKIHTRWTYIWCKM-QLBJFCOMSA-N
SMILES： CC(=O)Nc1nc2[C@@H](OC(=O)c3ccccc3)[C@H](OC(=O)c3ccccc3)[C@@H](COC(=O)c3ccccc3)Oc2s1
Systematic name  (3)：
  • ビス安息香酸(5R)-2-(アセチルアミノ)-5α-[(ベンゾイルオキシ)メチル]-6,7-ジヒドロ-5H-ピラノ[3,2-d]チアゾール-6β,7α-ジイル
  • (5R,6S,7R)-6-(ベンゾイルオキシ)-5-[(ベンゾイルオキシ)メチル]-2-アセトアミド-5H,6H,7H-ピラノ[3,2-d][1,3]チアゾール-7-イル ベンゾアート
  • (5R,6S,7R)-6-(benzoyloxy)-5-[(benzoyloxy)methyl]-2-acetamido-5H,6H,7H-pyrano[3,2-d][1,3]thiazol-7-yl benzoate
Other name (1)：
  • Bisbenzoic acid (5R)-2-(acetylamino)-5α-[(benzoyloxy)methyl]-6,7-dihydro-5H-pyrano[3,2-d]thiazole-6β,7α-diyl ester
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