| Name |
Dephinidin 3-(6-trans-caffeoylglucoside) |
| Formula |
C30H27O15 |
| Mw |
627.1349952 |
| CAS RN |
863107-06-6 |
| C_ID |
C00055135
|
| InChIKey |
CPESTIBYQUOXSA-LHRGPQAGSA-O |
| InChICode |
InChI=1S/C30H26O15/c31-14-8-17(33)15-10-22(29(43-21(15)9-14)13-6-19(35)25(38)20(36)7-13)44-30-28(41)27(40)26(39)23(45-30)11-42-24(37)4-2-12-1-3-16(32)18(34)5-12/h1-10,23,26-28,30,39-41H,11H2,(H6-,31,32,33,34,35,36,37,38)/p+1/t23-,26-,27+,28-,30-/m1/s1 |
| SMILES |
OC1=C2C([O+]=C(C(O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)COC(/C=C/C4=CC(O)=C(O)C=C4)=O)O)O)O)=C2)C5=CC(O)=C(C(O)=C5)O)=CC(O)=C1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Perilla frutescens  | Ref. |
|
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