Chem
J-GLOBAL ID:200907065102203008
Nikkaji number:J716.237E
Arabinothalictoside
アラビノタリクトシド
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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:
C19 H27 [N+]O11 [O-]
Molecular formula furigana:
C19-H27-N-O12
Molecular weight:
461.420
InChI:
InChI=1S/C19H27NO12/c21-11-7-29-18(16(25)13(11)22)30-8-12-14(23)15(24)17(26)19(32-12)31-10-3-1-9(2-4-10)5-6-20(27)28/h1-4,11-19,21-26H,5-8H2/t11-,12+,13-,14+,15-,16+,17+,18-,19+/m0/s1
InChI key:
ZHVLPKFAODFQST-UUOPEYFDSA-N
SMILES:
O[C@H]1CO[C@@H](OC[C@H]2O[C@@H](Oc3ccc(CC[N+](=O)[O-])cc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H]1O
Systematic name (3):
4-(2-ニトロエチル)フェニル6-O-α-L-アラビノピラノシル-β-D-グルコピラノシド
(2S,3R,4S,5S,6R)-2-[4-(2-ニトロエチル)フェノキシ]-6-({[(2S,3R,4S,5S)-3,4,5-トリヒドロキシオキサン-2-イル]オキシ}メチル)オキサン-3,4,5-トリオール
(2S,3R,4S,5S,6R)-2-[4-(2-nitroethyl)phenoxy]-6-({[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxane-3,4,5-triol
Other name (3):
アラビノタリクトシド
Arabinothalictoside
4-(2-Nitroethyl)phenyl 6-O-α-L-arabinopyranosyl-β-D-glucopyranoside
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