Chem
J-GLOBAL ID:201307095592744698
Nikkaji number:J3.198.288J
(2S)-2-[2-(Acetylamino)-2-deoxy-α-D-glucopyranosyloxy]butanedioic acid
(2S)-2-[2-(アセチルアミノ)-2-デオキシ-α-D-グルコピラノシルオキシ]ブタン二酸
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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:
C12 H19 NO10
Molecular formula furigana:
C12-H19-N-O10
Molecular weight:
337.281
InChI:
InChI=1S/C12H19NO10/c1-4(15)13-8-10(19)9(18)6(3-14)23-12(8)22-5(11(20)21)2-7(16)17/h5-6,8-10,12,14,18-19H,2-3H2,1H3,(H,13,15)(H,16,17)(H,20,21)/t5-,6+,8+,9+,10+,12-/m0/s1
InChI key:
COBMRTSHZAUOCY-BVKYVCSXSA-N
SMILES:
CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]1O[C@@H](CC(=O)O)C(=O)O
Systematic name (3):
(2S)-2-[2-(アセチルアミノ)-2-デオキシ-α-D-グルコピラノシルオキシ]ブタン二酸
(2S)-2-{[(2R,3R,4R,5S,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}ブタン二酸
(2S)-2-{[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butanedioic acid
Other name (1):
(2S)-2-[2-(Acetylamino)-2-deoxy-α-D-glucopyranosyloxy]butanedioic acid
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