Chem
J-GLOBAL ID:200907049985567483   Nikkaji number:J318.139A

3-O-β-D-Glucopyranuronosyl-2-(acetylamino)-2-deoxy-β-D-glucopyranose

3-O-β-D-グルコピラヌロノシル-2-(アセチルアミノ)-2-デオキシ-β-D-グルコピラノース
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: C14H23NO12
Molecular formula furigana: C14-H23-N-O12
Molecular weight: 397.333
InChI: InChI=1S/C14H23NO12/c1-3(17)15-5-10(6(18)4(2-16)25-13(5)24)26-14-9(21)7(19)8(20)11(27-14)12(22)23/h4-11,13-14,16,18-21,24H,2H2,1H3,(H,15,17)(H,22,23)/t4-,5-,6-,7+,8+,9-,10-,11+,13-,14-/m1/s1
InChI key: LJORHONFMDUUHP-VOGNPWKQSA-N
SMILES: CC(=O)N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(=O)O
Systematic name  (4):
  • 3-O-β-D-グルコピラヌロノシル-2-(アセチルアミノ)-2-デオキシ-β-D-グルコピラノース
  • 3-O-(β-D-グルコピラヌロノシル)-2-(アセチルアミノ)-2-デオキシ-β-D-グルコピラノース
  • (2S,3S,4S,5R,6R)-6-{[(2R,3R,4R,5S,6R)-3-アセトアミド-2,5-ジヒドロキシ-6-(ヒドロキシメチル)オキサン-4-イル]オキシ}-3,4,5-トリヒドロキシオキサン-2-カルボン酸
  • (2S,3S,4S,5R,6R)-6-{[(2R,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
Other name (2):
  • 3-O-β-D-Glucopyranuronosyl-2-(acetylamino)-2-deoxy-β-D-glucopyranose
  • 3-O-(β-D-Glucopyranuronosyl)-2-(acetylamino)-2-deoxy-β-D-glucopyranose
CAS registry number: 97747-46-1
Regulation number (1):
  • EINECS3077804
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