Chem
J-GLOBAL ID:200907007867998955
Nikkaji number:J462.545E
3′-Methoxy-4′,5′,7-trihydroxy-3,5-bis(β-D-glucopyranosyloxy)flavylium
3′-メトキシ-4′,5′,7-トリヒドロキシ-3,5-ビス(β-D-グルコピラノシルオキシ)フラビリウム
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:
C28 H33 O16 [O+]
Molecular formula furigana:
C28-H33-O17
Molecular weight:
641.554
InChI:
InChI=1S/C28H32O17/c1-40-15-3-9(2-12(32)19(15)33)26-16(43-28-25(39)23(37)21(35)18(8-30)45-28)6-11-13(41-26)4-10(31)5-14(11)42-27-24(38)22(36)20(34)17(7-29)44-27/h2-6,17-18,20-25,27-30,34-39H,7-8H2,1H3,(H2-,31,32,33)/p+1/t17-,18-,20-,21-,22+,23+,24-,25-,27-,28-/m1/s1
InChI key:
KLRABYJGMPNMSA-ZUUMSKAQSA-O
SMILES:
COc1cc(cc(O)c1O)c1[o+]c2cc(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Systematic name (6):
2-(3,4-ジヒドロキシ-5-メトキシフェニル)-7-ヒドロキシ-3,5-ビス(β-D-グルコピラノシルオキシ)-1-ベンゾピリリウム
3,5-ビス(β-D-グルコピラノシルオキシ)-7-ヒドロキシ-2-(3,4-ジヒドロキシ-5-メトキシフェニル)-1-ベンゾピリリウム
3′-メトキシ-4′,5′,7-トリヒドロキシ-3,5-ビス(β-D-グルコピラノシルオキシ)フラビリウム
3,5-ビス(β-D-グルコピラノシルオキシ)-3′,4′,7-トリヒドロキシ-5′-メトキシフラビリウム
2-(3,4-ジヒドロキシ-5-メトキシフェニル)-7-ヒドロキシ-3,5-ビス({[(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})-1λ4 -クロメン-1-イリウム
2-(3,4-dihydroxy-5-methoxyphenyl)-7-hydroxy-3,5-bis({[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})-1λ4 -chromen-1-ylium
Show all
Other name (3):
3,5-Bis(β-D-glucopyranosyloxy)-7-hydroxy-2-(3,4-dihydroxy-5-methoxyphenyl)-1-benzopyrylium
3′-Methoxy-4′,5′,7-trihydroxy-3,5-bis(β-D-glucopyranosyloxy)flavylium
3,5-Bis(β-D-glucopyranosyloxy)-3′,4′,7-trihydroxy-5′-methoxyflavylium
Thsaurus map:
Return to Previous Page