Chem
J-GLOBAL ID:200907000059213113   Nikkaji number:J1.453.428H

3-O-(2-O-Sulfo-3,6-anhydro-α-D-galactopyranosyl)-β-D-galactopyranose 2,4-bissulfate

3-O-(2-O-スルホ-3,6-アンヒドロ-α-D-ガラクトピラノシル)-β-D-ガラクトピラノース2,4-ビススルファート
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: C12H20O19S3
Molecular formula furigana: C12-H20-O19-S3
Molecular weight: 564.450
InChI: InChI=1S/C12H20O19S3/c13-1-3-6(29-32(16,17)18)8(9(11(15)26-3)30-33(19,20)21)28-12-10(31-34(22,23)24)7-5(14)4(27-12)2-25-7/h3-15H,1-2H2,(H,16,17,18)(H,19,20,21)(H,22,23,24)/t3-,4-,5+,6+,7+,8+,9-,10-,11-,12-/m1/s1
InChI key: IUJJNKMWYGTWJG-WSWWMNSNSA-N
SMILES: OC[C@H]1O[C@@H](O)[C@H](OS(=O)(=O)O)[C@@H](O[C@H]2O[C@@H]3CO[C@@H]([C@H]3O)[C@H]2OS(=O)(=O)O)[C@H]1OS(=O)(=O)O
Systematic name  (3):
  • 3-O-(2-O-スルホ-3,6-アンヒドロ-α-D-ガラクトピラノシル)-β-D-ガラクトピラノース2,4-ビススルファート
  • [(1R,3R,4R,5S,8S)-8-ヒドロキシ-3-{[(2R,3R,4S,5S,6R)-2-ヒドロキシ-6-(ヒドロキシメチル)-3,5-ビス(スルホオキシ)オキサン-4-イル]オキシ}-2,6-ジオキサビシクロ[3.2.1]オクタン-4-イル]オキシダンスルホン酸
  • [(1R,3R,4R,5S,8S)-8-hydroxy-3-{[(2R,3R,4S,5S,6R)-2-hydroxy-6-(hydroxymethyl)-3,5-bis(sulfooxy)oxan-4-yl]oxy}-2,6-dioxabicyclo[3.2.1]octan-4-yl]oxidanesulfonic acid
Other name (1):
  • 3-O-(2-O-Sulfo-3,6-anhydro-α-D-galactopyranosyl)-β-D-galactopyranose 2,4-bissulfate
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