| Name |
Petunidin 3-(6''-p-coumarylglucoside)-5-glucoside |
| Formula |
C37H39O19 |
| Mw |
787.20855407 |
| CAS RN |
51939-66-3 |
| C_ID |
C00006898
, 
|
| InChIKey |
ZGMRIMVMTYZQLM-BDXWVHQLNA-O |
| InChICode |
InChI=1S/C37H38O19/c1-50-23-9-16(8-20(41)28(23)43)35-24(12-19-21(52-35)10-18(40)11-22(19)53-36-33(48)31(46)29(44)25(13-38)55-36)54-37-34(49)32(47)30(45)26(56-37)14-51-27(42)7-4-15-2-5-17(39)6-3-15/h2-12,25-26,29-34,36-38,44-49H,13-14H2,1H3,(H3-,39,40,41,42,43)/p+1/t25-,26+,29+,30+,31-,32-,33+,34-,36+,37+/m0/s1 |
| SMILES |
COc1cc(-c2[o+]c3cc(O)cc(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c3cc2O[C@@H]2OC(COC(=O)/C=C/c3ccc(O)cc3)[C@@H](O)C(O)C2O)cc(O)c1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Vitaceae | Vitis rotundifolia  | Ref. |
|
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