Chem
J-GLOBAL ID:200907058698322290
Nikkaji number:J14.192E
Lucumin
ルクミン
Download MOL file
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 H25 NO10
Molecular formula furigana:
C19-H25-N-O10
Molecular weight:
427.406
InChI:
InChI=1S/C19H25NO10/c20-6-11(9-4-2-1-3-5-9)29-19-17(26)15(24)14(23)12(30-19)8-28-18-16(25)13(22)10(21)7-27-18/h1-5,10-19,21-26H,7-8H2/t10-,11+,12-,13+,14-,15+,16-,17-,18+,19-/m1/s1
InChI key:
YYYCJNDALLBNEG-DZMQVIFMSA-N
SMILES:
O[C@@H]1CO[C@@H](OC[C@H]2O[C@@H](O[C@@H](C#N)c3ccccc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H]1O
Systematic name (3):
(αR)-α-[(6-O-β-D-キシロピラノシル-β-D-グルコピラノシル)オキシ]ベンゼンアセトニトリル
(2R)-2-フェニル-2-{[(2R,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-({[(2S,3R,4S,5R)-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-2-イル]オキシ}アセトニトリル
(2R)-2-phenyl-2-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxan-2-yl]oxy}acetonitrile
Other name (5):
ルクミン
Lucumin
(αR)-α-[(6-O-β-D-Xylopyranosyl-β-D-glucopyranosyl)oxy]benzeneacetonitrile
(R)-ルクミン
(R)-Lucumin
CAS registry number:
1392-28-5
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