Chem
J-GLOBAL ID:200907020965757733
Nikkaji number:J1.715.403F
3′,4′,5-Trihydroxy-3-[2-O,6-O-bis(α-L-rhamnopyranosyl)-4-O-(4-hydroxy-trans-cinnamoyl)-β-D-galactopyranosyloxy]-7-(α-L-rhamnopyranosyloxy)flavone
3′,4′,5-トリヒドロキシ-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-trans-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
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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:
C48 H56 O26
Molecular formula furigana:
C48-H56-O26
Molecular weight:
1048.950
InChI:
InChI=1S/C48H56O26/c1-16-30(54)34(58)37(61)45(66-16)65-15-27-42(72-28(53)11-6-19-4-8-21(49)9-5-19)40(64)44(74-47-39(63)36(60)32(56)18(3)68-47)48(71-27)73-43-33(57)29-25(52)13-22(69-46-38(62)35(59)31(55)17(2)67-46)14-26(29)70-41(43)20-7-10-23(50)24(51)12-20/h4-14,16-18,27,30-32,34-40,42,44-52,54-56,58-64H,15H2,1-3H3/b11-6+/t16-,17-,18-,27+,30-,31-,32-,34+,35+,36+,37+,38+,39+,40-,42-,44+,45+,46-,47-,48-/m0/s1
InChI key:
FSYBLFADTRSXRO-QUYCVNCRSA-N
SMILES:
C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(oc4cc(O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)cc(O)c4c3=O)c3ccc(O)c(O)c3)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H]2OC(=O)/C=C/c2ccc(O)cc2)[C@H](O)[C@H](O)[C@H]1O
Systematic name (3):
3′,4′,5-トリヒドロキシ-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-trans-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)-6-{[2-(3,4-ジヒドロキシフェニル)-5-ヒドロキシ-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}-4-ヒドロキシ-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 (2E)-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)-6-{[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-7-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-4H-chromen-3-yl]oxy}-4-hydroxy-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 (2E)-3-(4-hydroxyphenyl)prop-2-enoate
Other name (1):
3′,4′,5-Trihydroxy-3-[2-O,6-O-bis(α-L-rhamnopyranosyl)-4-O-(4-hydroxy-trans-cinnamoyl)-β-D-galactopyranosyloxy]-7-(α-L-rhamnopyranosyloxy)flavone
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