Name |
Pelargonidin 3-(6''-acetylglucoside)-5-glucoside |
Formula |
C29H33O16 |
Mw |
637.17686001 |
CAS RN |
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C_ID |
C00006761
,
|
InChIKey |
MJVQNNAMTLJZPX-SFYWUSEQNA-O |
InChICode |
InChI=1S/C29H32O16/c1-11(31)40-10-20-22(35)24(37)26(39)29(45-20)43-18-8-15-16(41-27(18)12-2-4-13(32)5-3-12)6-14(33)7-17(15)42-28-25(38)23(36)21(34)19(9-30)44-28/h2-8,19-26,28-30,34-39H,9-10H2,1H3,(H-,32,33)/p+1/t19-,20+,21+,22+,23-,24-,25-,26+,28+,29+/m0/s1 |
SMILES |
c1(cc(c2c(c1)[o+]c(c(c2)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)C)O)O)O)c1ccc(cc1)O)O[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)O |
Start Substs in Alk. Biosynthesis (Prediction) |
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Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Verbenaceae | Verbena x hybrida | Ref. |
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