Chem
J-GLOBAL ID：200907077445322183   Nikkaji number：J1.715.406K

3′-Methoxy-4′,5-dihydroxy-3-[2-O,6-O-bis(α-L-rhamnopyranosyl)-4-O-(4-hydroxy-cis-cinnamoyl)-β-D-galactopyranosyloxy]-7-(α-L-rhamnopyranosyloxy)flavone

3′-メトキシ-4′,5-ジヒドロキシ-3-[2-O,6-O-ビス(α-L-ラムノピラノシル)-4-O-(4-ヒドロキシ-cis-シンナモイル)-β-D-ガラクトピラノシルオキシ]-7-(α-L-ラムノピラノシルオキシ)フラボン
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： C49H58O26
Molecular formula furigana： C49-H58-O26
Molecular weight： 1062.977
InChI： InChI=1S/C49H58O26/c1-17-31(54)35(58)38(61)46(67-17)66-16-28-43(73-29(53)12-7-20-5-9-22(50)10-6-20)41(64)45(75-48-40(63)37(60)33(56)19(3)69-48)49(72-28)74-44-34(57)30-25(52)14-23(70-47-39(62)36(59)32(55)18(2)68-47)15-27(30)71-42(44)21-8-11-24(51)26(13-21)65-4/h5-15,17-19,28,31-33,35-41,43,45-52,54-56,58-64H,16H2,1-4H3/b12-7-/t17-,18-,19-,28+,31-,32-,33-,35+,36+,37+,38+,39+,40+,41-,43-,45+,46+,47-,48-,49-/m0/s1
InChI key： KCTSSLHVUQETDR-SPSBGASPSA-N
SMILES： COc1cc(ccc1O)c1oc2cc(O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)cc(O)c2c(=O)c1O[C@@H]1O[C@H](CO[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)[C@H](OC(=O)/C=C\c2ccc(O)cc2)[C@H](O)[C@H]1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O
Systematic name  (3)：
  • 3′-メトキシ-4′,5-ジヒドロキシ-3-[2-O,6-O-ビス(α-L-ラムノピラノシル)-4-O-(4-ヒドロキシ-cis-シンナモイル)-β-D-ガラクトピラノシルオキシ]-7-(α-L-ラムノピラノシルオキシ)フラボン
  • (2R,3R,4S,5R,6S)-4-ヒドロキシ-6-{[5-ヒドロキシ-2-(4-ヒドロキシ-3-メトキシフェニル)-4-オキソ-7-{[(2S,3R,4R,5R,6S)-3,4,5-トリヒドロキシ-6-メチルオキサン-2-イル]オキシ}-4H-クロメン-3-イル]オキシ}-5-{[(2S,3R,4R,5R,6S)-3,4,5-トリヒドロキシ-6-メチルオキサン-2-イル]オキシ}-2-({[(2R,3R,4R,5R,6S)-3,4,5-トリヒドロキシ-6-メチルオキサン-2-イル]オキシ}メチル)オキサン-3-イル (2Z)-3-(4-ヒドロキシフェニル)プロパ-2-エノアート
  • (2R,3R,4S,5R,6S)-4-hydroxy-6-{[5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-7-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-4H-chromen-3-yl]oxy}-5-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-2-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-3-yl (2Z)-3-(4-hydroxyphenyl)prop-2-enoate
Other name (1)：
  • 3′-Methoxy-4′,5-dihydroxy-3-[2-O,6-O-bis(α-L-rhamnopyranosyl)-4-O-(4-hydroxy-cis-cinnamoyl)-β-D-galactopyranosyloxy]-7-(α-L-rhamnopyranosyloxy)flavone
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