Chem
J-GLOBAL ID：200907088148539744   Nikkaji number：J2.016.448D

1-O-(4-Nitrophenyl)-N-acetyl-4-O-(sodiooxysulfonyl)-β-D-glucosamine

1-O-(4-ニトロフェニル)-N-アセチル-4-O-(ソジオオキシスルホニル)-β-D-グルコサミン
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： C14H17N[N+]NaO10[O-]S
Molecular formula furigana： C14-H17-N2-NA-O11-S
Molecular weight： 444.340
InChI： InChI=1S/C14H18N2O11S.Na/c1-7(18)15-11-12(19)13(27-28(22,23)24)10(6-17)26-14(11)25-9-4-2-8(3-5-9)16(20)21;/h2-5,10-14,17,19H,6H2,1H3,(H,15,18)(H,22,23,24);/q;+1/p-1/t10-,11-,12-,13-,14-;/m1./s1
InChI key： IBKVWOFAQOLZRN-XAWYEFCRSA-M
SMILES： CC(=O)N[C@@H]1[C@@H](O)[C@H](OS(=O)(=O)O[Na])[C@@H](CO)O[C@H]1Oc1ccc(cc1)[N+](=O)[O-]
Systematic name  (3)：
  • 1-O-(4-ニトロフェニル)-N-アセチル-4-O-(ソジオオキシスルホニル)-β-D-グルコサミン
  • (2R,3S,4R,5R,6S)-5-アセトアミド-4-ヒドロキシ-2-(ヒドロキシメチル)-6-(4-ニトロフェノキシ)オキサン-3-イル ナトリウム スルファート
  • (2R,3S,4R,5R,6S)-5-acetamido-4-hydroxy-2-(hydroxymethyl)-6-(4-nitrophenoxy)oxan-3-yl sodium sulfate
Other name (1)：
  • 1-O-(4-Nitrophenyl)-N-acetyl-4-O-(sodiooxysulfonyl)-β-D-glucosamine
Thsaurus map：
Thesaurus Map

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