Chem
J-GLOBAL ID:201207027744517193
Nikkaji number:J3.005.991C
[2-(2-Aminoethoxy)ethyl]β-lactoside
[2-(2-アミノエトキシ)エチル]β-ラクトシド
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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:
C16 H31 NO12
Molecular formula furigana:
C16-H31-N-O12
Molecular weight:
429.419
InChI:
InChI=1S/C16H31NO12/c17-1-2-25-3-4-26-15-13(24)11(22)14(8(6-19)28-15)29-16-12(23)10(21)9(20)7(5-18)27-16/h7-16,18-24H,1-6,17H2/t7-,8-,9+,10+,11-,12-,13-,14-,15-,16+/m1/s1
InChI key:
CXVOMBXPWPRHKP-FZVFFMNZSA-N
SMILES:
NCCOCCO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O
Systematic name (3):
[2-(2-アミノエトキシ)エチル]β-ラクトシド
(2S,3R,4S,5R,6R)-2-{[(2R,3S,4R,5R,6R)-6-[2-(2-アミノエトキシ)エトキシ]-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,3S,4R,5R,6R)-6-[2-(2-aminoethoxy)ethoxy]-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Other name (1):
[2-(2-Aminoethoxy)ethyl]β-lactoside
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