Chem
J-GLOBAL ID:200907005047708054
Nikkaji number:J743.728E
Acetic acid 4α-(benzoyloxy)-5β-(benzoyloxymethyl)thiolan-2β-yl ester
酢酸4α-(ベンゾイルオキシ)-5β-(ベンゾイルオキシメチル)チオラン-2β-イル
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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:
C21 H20 O6 S
Molecular formula furigana:
C21-H20-O6-S
Molecular weight:
400.450
InChI:
InChI=1S/C21H20O6S/c1-14(22)26-19-12-17(27-21(24)16-10-6-3-7-11-16)18(28-19)13-25-20(23)15-8-4-2-5-9-15/h2-11,17-19H,12-13H2,1H3/t17-,18+,19+/m0/s1
InChI key:
YSFKDGRWKDRJDF-IPMKNSEASA-N
SMILES:
CC(=O)O[C@H]1C[C@H](OC(=O)c2ccccc2)[C@@H](COC(=O)c2ccccc2)S1
Systematic name (3):
酢酸4α-(ベンゾイルオキシ)-5β-(ベンゾイルオキシメチル)チオラン-2β-イル
(2R,3S,5R)-5-(アセチルオキシ)-2-[(ベンゾイルオキシ)メチル]チオラン-3-イル ベンゾアート
(2R,3S,5R)-5-(acetyloxy)-2-[(benzoyloxy)methyl]thiolan-3-yl benzoate
Other name (1):
Acetic acid 4α-(benzoyloxy)-5β-(benzoyloxymethyl)thiolan-2β-yl ester
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