Chem
J-GLOBAL ID:200907074850703039   Nikkaji number:J947.541I

Pelargonidin 3-O-rutinoside

ペラルゴニジン3-O-ルチノシド
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: C27H31O13[O+]
Molecular formula furigana: C27-H31-O14
Molecular weight: 579.530
InChI: InChI=1S/C27H30O14/c1-10-19(31)21(33)23(35)26(38-10)37-9-18-20(32)22(34)24(36)27(41-18)40-17-8-14-15(30)6-13(29)7-16(14)39-25(17)11-2-4-12(28)5-3-11/h2-8,10,18-24,26-27,31-36H,9H2,1H3,(H2-,28,29,30)/p+1/t10-,18+,19-,20+,21+,22-,23+,24+,26+,27+/m0/s1
InChI key: IFYOHQQBIKDHFT-ASZXTAQUSA-O
SMILES: C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc4c(O)cc(O)cc4[o+]c3c3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
Systematic name  (7):
  • 2-(4-ヒドロキシフェニル)-3-[(6-O-α-L-ラムノピラノシル-β-D-グルコピラノシル)オキシ]-5,7-ジヒドロキシ-1-ベンゾピリリウム
  • 4′,5,7-トリヒドロキシ-3-(6-O-α-L-ラムノピラノシル-β-D-グルコピラノシルオキシ)アントシアニジン
  • 3-(6-O-α-L-ラムノピラノシル-β-D-グルコピラノシルオキシ)-4′,5,7-トリヒドロキシアントシアニジン
  • 3-(6-O-α-L-ラムノピラノシル-β-D-グルコピラノシルオキシ)-4′,5,7-トリヒドロキシフラビリウム
  • 3-[(6-O-α-L-ラムノピラノシル-β-D-グルコピラノシル)オキシ]-2-(4-ヒドロキシフェニル)-5,7-ジヒドロキシ-1-ベンゾピリリウム
Show all
Other name (9):
  • 2-(4-Hydroxyphenyl)-3-[(6-O-α-L-rhamnopyranosyl-β-D-glucopyranosyl)oxy]-5,7-dihydroxy-1-benzopyrylium
  • 4′,5,7-Trihydroxy-3-(6-O-α-L-rhamnopyranosyl-β-D-glucopyranosyloxy)anthocyanidin
  • ペラルゴニジン3-(6′′-ラムノシルグルコシド)
  • Pelargonidin 3-(6′′-rhamnosylglucoside)
  • 3-(6-O-α-L-Rhamnopyranosyl-β-D-glucopyranosyloxy)-4′,5,7-trihydroxyanthocyanidin
Show all
KEGG COMPOUND: C12644
Thsaurus map:

Return to Previous Page