Chem
J-GLOBAL ID：200907089332320867   Nikkaji number：J1.230.122G

2-O,3-O,4-O-Tribenzoyl-6-O-methyl-α-D-glucopyranuronosyl bromide

2-O,3-O,4-O-トリベンゾイル-6-O-メチル-α-D-グルコピラヌロノシルブロミド
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： C28H23BrO9
Molecular formula furigana： C28-H23-BR-O9
Molecular weight： 583.387
InChI： InChI=1S/C28H23BrO9/c1-34-28(33)23-21(37-26(31)18-13-7-3-8-14-18)20(36-25(30)17-11-5-2-6-12-17)22(24(29)35-23)38-27(32)19-15-9-4-10-16-19/h2-16,20-24H,1H3/t20-,21-,22+,23-,24-/m0/s1
InChI key： KXTNIKNREDJJSO-LKTXNROYSA-N
SMILES： COC(=O)[C@H]1O[C@H](Br)[C@H](OC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1
Systematic name  (4)：
  • 1-ブロモ-2-O,3-O,4-O-トリベンゾイル-1-デオキシ-α-D-グルコピラヌロン酸メチル
  • 2-O,3-O,4-O-トリベンゾイル-6-O-メチル-α-D-グルコピラヌロノシルブロミド
  • メチル (2S,3S,4S,5R,6R)-3,4,5-トリス(ベンゾイルオキシ)-6-ブロモオキサン-2-カルボキシラート
  • methyl (2S,3S,4S,5R,6R)-3,4,5-tris(benzoyloxy)-6-bromooxane-2-carboxylate
Other name (2)：
  • 1-Bromo-2-O,3-O,4-O-tribenzoyl-1-deoxy-α-D-glucopyranuronic acid methyl ester
  • 2-O,3-O,4-O-Tribenzoyl-6-O-methyl-α-D-glucopyranuronosyl bromide
Thsaurus map：
Thesaurus Map

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