Chem
J-GLOBAL ID:200907034383738786
Nikkaji number:J929.874F
(2S)-2′,5′-Dimethoxy-5-hydroxy-6,8-dimethyl-7-(β-D-glucopyranosyloxy)flavanone
(2S)-2′,5′-ジメトキシ-5-ヒドロキシ-6,8-ジメチル-7-(β-D-グルコピラノシルオキシ)フラバノン
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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:
C25 H30 O11
Molecular formula furigana:
C25-H30-O11
Molecular weight:
506.504
InChI:
InChI=1S/C25H30O11/c1-10-19(28)18-14(27)8-16(13-7-12(32-3)5-6-15(13)33-4)34-24(18)11(2)23(10)36-25-22(31)21(30)20(29)17(9-26)35-25/h5-7,16-17,20-22,25-26,28-31H,8-9H2,1-4H3/t16-,17+,20+,21-,22+,25-/m0/s1
InChI key:
MUKYIRHASCIADI-NZIACLKUSA-N
SMILES:
COc1ccc(OC)c(c1)[C@@H]1CC(=O)c2c(O)c(C)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(C)c2O1
Systematic name (3):
(2S)-2′,5′-ジメトキシ-5-ヒドロキシ-6,8-ジメチル-7-(β-D-グルコピラノシルオキシ)フラバノン
(2S)-2-(2,5-ジメトキシフェニル)-5-ヒドロキシ-6,8-ジメチル-7-{[(2S,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}-3,4-ジヒドロ-2H-1-ベンゾピラン-4-オン
(2S)-2-(2,5-dimethoxyphenyl)-5-hydroxy-6,8-dimethyl-7-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-one
Other name (1):
(2S)-2′,5′-Dimethoxy-5-hydroxy-6,8-dimethyl-7-(β-D-glucopyranosyloxy)flavanone
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