| Name |
Malvidin 3-O-(6-O-(4-O-caffeoyl-alpha-rhamnopyranosyl)-beta-glucopyranoside) |
| Formula |
C38H41O19 |
| Mw |
801.22420413 |
| CAS RN |
769106-18-5 |
| C_ID |
C00014828
, 
|
| InChIKey |
OTVHGFISQWNLDE-GAOCHHRFNA-O |
| InChICode |
InChI=1S/C38H40O19/c1-15-35(57-28(43)7-5-16-4-6-20(40)22(42)8-16)32(47)34(49)37(53-15)52-14-27-30(45)31(46)33(48)38(56-27)55-26-13-19-21(41)11-18(39)12-23(19)54-36(26)17-9-24(50-2)29(44)25(10-17)51-3/h4-13,15,27,30-35,37-38,45-49H,14H2,1-3H3,(H4-,39,40,41,42,43,44)/p+1/t15-,27+,30-,31+,32-,33+,34-,35-,37+,38+/m0/s1 |
| SMILES |
COc1cc(-c2[o+]c3cc(O)cc(O)c3cc2O[C@@H]2O[C@H](CO[C@@H]3OC(C)[C@H](OC(=O)/C=C/c4ccc(O)c(O)c4)C(O)[C@@H]3O)[C@@H](O)C(O)C2O)cc(OC)c1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Solanaceae | Petunia integrifolia subsp. inflata | Ref. |
|
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