| Name |
Petunidin 3-glucoside-5-(6''-acetylglucoside) |
| Formula |
C30H35O18 |
| Mw |
683.18233932 |
| CAS RN |
202661-56-1 |
| C_ID |
C00014858
, 
|
| InChIKey |
BPHSJTQXYOIEMV-RLLYGBSKNA-O |
| InChICode |
InChI=1S/C30H34O18/c1-10(32)43-9-20-23(37)25(39)27(41)29(48-20)45-16-6-12(33)5-15-13(16)7-18(46-30-26(40)24(38)22(36)19(8-31)47-30)28(44-15)11-3-14(34)21(35)17(4-11)42-2/h3-7,19-20,22-27,29-31,36-41H,8-9H2,1-2H3,(H2-,33,34,35)/p+1/t19-,20-,22+,23+,24+,25+,26-,27-,29-,30-/m1/s1 |
| SMILES |
COc1cc(-c2[o+]c3cc(O)cc(O[C@@H]4OC(COC(C)=O)[C@@H](O)[C@H](O)C4O)c3cc2O[C@@H]2OC(CO)[C@@H](O)[C@H](O)C2O)cc(O)c1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Geraniaceae | Pelargonium dolomiticum | Ref. |
|
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