Chem
J-GLOBAL ID：201007014086803846   Nikkaji number：J2.872.356C

2-(Acetylamino)-2-deoxy-6-O-[6-O-(N-acetyl-α-neuraminosyl)-β-D-galactopyranosyl]-D-glucopyranose

2-(アセチルアミノ)-2-デオキシ-6-O-[6-O-(N-アセチル-α-ノイラミノシル)-β-D-ガラクトピラノシル]-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： C25H42N2O19
Molecular formula furigana： C25-H42-N2-O19
Molecular weight： 674.606
InChI： InChI=1S/C25H42N2O19/c1-7(29)26-13-9(31)3-25(24(40)41,46-21(13)15(33)10(32)4-28)43-6-12-17(35)19(37)20(38)23(45-12)42-5-11-16(34)18(36)14(22(39)44-11)27-8(2)30/h9-23,28,31-39H,3-6H2,1-2H3,(H,26,29)(H,27,30)(H,40,41)/t9-,10+,11+,12+,13+,14+,15+,16+,17-,18+,19-,20+,21+,22?,23+,25+/m0/s1
InChI key： NMSGYBRLMOIHGN-GAWGPGJYSA-N
SMILES： CC(=O)N[C@H]1C(O)O[C@H](CO[C@@H]2O[C@H](CO[C@@]3(C[C@H](O)[C@@H](NC(=O)C)[C@@H](O3)[C@H](O)[C@H](O)CO)C(=O)O)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O
Systematic name  (3)：
  • 2-(アセチルアミノ)-2-デオキシ-6-O-[6-O-(N-アセチル-α-ノイラミノシル)-β-D-ガラクトピラノシル]-D-グルコピラノース
  • (2R,4S,5R,6R)-5-アセトアミド-2-{[(2R,3R,4S,5R,6R)-6-{[(2R,3S,4R,5R)-5-アセトアミド-3,4,6-トリヒドロキシオキサン-2-イル]メトキシ}-3,4,5-トリヒドロキシオキサン-2-イル]メトキシ}-4-ヒドロキシ-6-[(1R,2R)-1,2,3-トリヒドロキシプロピル]オキサン-2-カルボン酸
  • (2R,4S,5R,6R)-5-acetamido-2-{[(2R,3R,4S,5R,6R)-6-{[(2R,3S,4R,5R)-5-acetamido-3,4,6-trihydroxyoxan-2-yl]methoxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
Other name (1)：
  • 2-(Acetylamino)-2-deoxy-6-O-[6-O-(N-acetyl-α-neuraminosyl)-β-D-galactopyranosyl]-D-glucopyranose
Thsaurus map：
Thesaurus Map

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