Chem
J-GLOBAL ID：200907027693286498   Nikkaji number：J1.903.511E

GalNAc-Isofagomine

GalNAc-イソファゴミン
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： C8H17N[N+]O4
Molecular formula furigana： C8-H17-N2-O4
Molecular weight： 205.233
InChI： InChI=1S/C8H16N2O4/c1-4(12)10-8-7(14)6(13)5(3-11)2-9-8/h5-9,11,13-14H,2-3H2,1H3,(H,10,12)/p+1/t5-,6+,7+,8+/m1/s1
InChI key： IWVRQJNSUOIUFV-KVPKETBZSA-O
SMILES： CC(=O)N[C@@H]1[NH2+]C[C@H](CO)[C@H](O)[C@@H]1O
Systematic name  (3)：
  • (2R)-2α-(アセチルアミノ)-3β,4β-ジヒドロキシ-5β-(ヒドロキシメチル)ピペリジニウム
  • (2R,3R,4S,5R)-2-アセトアミド-3,4-ジヒドロキシ-5-(ヒドロキシメチル)ピペリジン-1-イウム
  • (2R,3R,4S,5R)-2-acetamido-3,4-dihydroxy-5-(hydroxymethyl)piperidin-1-ium
Other name (3)：
  • (2R)-2α-(Acetylamino)-3β,4β-dihydroxy-5β-(hydroxymethyl)piperidinium
  • GalNAc-イソファゴミン
  • GalNAc-Isofagomine
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