Chem
J-GLOBAL ID:200907034134325382
Nikkaji number:J1.235.645E
P1 trisaccharide
P1三糖
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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:
C20 H35 NO16
Molecular formula furigana:
C20-H35-N-O16
Molecular weight:
545.491
InChI:
InChI=1S/C20H35NO16/c1-5(25)21-9-11(27)16(7(3-23)33-18(9)32)36-20-15(31)13(29)17(8(4-24)35-20)37-19-14(30)12(28)10(26)6(2-22)34-19/h6-20,22-24,26-32H,2-4H2,1H3,(H,21,25)/t6-,7-,8-,9-,10+,11-,12+,13-,14-,15-,16-,17+,18-,19-,20+/m1/s1
InChI key:
QOITYCLKNIWNMP-JEUPZEFZSA-N
SMILES:
CC(=O)N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@@H]1O
Systematic name (4):
4-O-(4-O-α-D-ガラクトピラノシル-β-D-ガラクトピラノシル)-2-アセチルアミノ-2-デオキシ-β-D-グルコピラノース
4-O-(4-O-α-D-ガラクトピラノシル-β-D-ガラクトピラノシル)-N-アセチル-β-D-グルコサミン
N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4R,5R,6R)-3,4-ジヒドロキシ-6-(ヒドロキシメチル)-5-{[(2R,3R,4S,5R,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}オキサン-2-イル]オキシ}-2,4-ジヒドロキシ-6-(ヒドロキシメチル)オキサン-3-イル]アセトアミド
N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4R,5R,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-{[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
Other name (4):
4-O-(4-O-α-D-Galactopyranosyl-β-D-galactopyranosyl)-2-acetylamino-2-deoxy-β-D-glucopyranose
4-O-(4-O-α-D-Galactopyranosyl-β-D-galactopyranosyl)-N-acetyl-β-D-glucosamine
P1三糖
P1 trisaccharide
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