Chem
J-GLOBAL ID：200907038971954024   Nikkaji number：J1.938.401B

GalNAcβ1-4GlcNAcβ1-Octyl

GalNAcβ1-4GlcNAcβ1-オクチル
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： C24H44N2O11
Molecular formula furigana： C24-H44-N2-O11
Molecular weight： 536.619
InChI： InChI=1S/C24H44N2O11/c1-4-5-6-7-8-9-10-34-23-18(26-14(3)30)21(33)22(16(12-28)36-23)37-24-17(25-13(2)29)20(32)19(31)15(11-27)35-24/h15-24,27-28,31-33H,4-12H2,1-3H3,(H,25,29)(H,26,30)/t15-,16-,17-,18-,19+,20-,21-,22-,23-,24+/m1/s1
InChI key： YXTGZKPCRILWSW-GFXKSZTESA-N
SMILES： CCCCCCCCO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2NC(=O)C)[C@H](O)[C@H]1NC(=O)C
Systematic name  (3)：
  • オクチル4-O-[2-(アセチルアミノ)-2-デオキシ-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-グルコピラノシド
  • N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4R,5R,6R)-3-アセトアミド-4,5-ジヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}-4-ヒドロキシ-6-(ヒドロキシメチル)-2-(オクチルオキシ)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-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-hydroxy-6-(hydroxymethyl)-2-(octyloxy)oxan-3-yl]acetamide
Other name (4)：
  • Octyl 4-O-[2-(acetylamino)-2-deoxy-β-D-galactopyranosyl]2-(acetylamino)-2-deoxy-β-D-glucopyranoside
  • GalNAcβ1-4GlcNAcβ1-オクチル
  • GalNAcβ1-4GlcNAcβ1-octyl
  • GalNAcβ1-4GlcNAcβ1-Octyl
Thsaurus map：
Thesaurus Map

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