Chem
J-GLOBAL ID:200907066420043679
Nikkaji number:J2.187.707G
4-Aminophenyl 4-O-(β-D-galactopyranosyl)-β-D-galactopyranoside
4-アミノフェニル4-O-(β-D-ガラクトピラノシル)-β-D-ガラクトピラノシド
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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:
C18 H27 NO11
Molecular formula furigana:
C18-H27-N-O11
Molecular weight:
433.410
InChI:
InChI=1S/C18H27NO11/c19-7-1-3-8(4-2-7)27-17-15(26)13(24)16(10(6-21)29-17)30-18-14(25)12(23)11(22)9(5-20)28-18/h1-4,9-18,20-26H,5-6,19H2/t9-,10-,11+,12+,13-,14-,15-,16+,17-,18+/m1/s1
InChI key:
OCHWUNNDLIWPAO-BQVHMPCVSA-N
SMILES:
Nc1ccc(O[C@@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1
Systematic name (3):
4-アミノフェニル4-O-(β-D-ガラクトピラノシル)-β-D-ガラクトピラノシド
(2S,3R,4S,5R,6R)-2-{[(2R,3R,4R,5R,6S)-6-(4-アミノフェノキシ)-4,5-ジヒドロキシ-2-(ヒドロキシメチル)オキサン-3-イル]オキシ}-6-(ヒドロキシメチル)オキサン-3,4,5-トリオール
(2S,3R,4S,5R,6R)-2-{[(2R,3R,4R,5R,6S)-6-(4-aminophenoxy)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Other name (1):
4-Aminophenyl 4-O-(β-D-galactopyranosyl)-β-D-galactopyranoside
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