Name |
Cyanidin 3-(6''-p-coumarylsambubioside) |
Formula |
C35H35O17 |
Mw |
727.1874247 |
CAS RN |
162972-64-7 |
C_ID |
C00006802
,
|
InChIKey |
KMIJRKZNTFVLAI-UHFFFAOYNA-O |
InChICode |
InChI=1S/C35H34O17/c36-17-5-1-15(2-6-17)3-8-27(42)47-14-26-29(44)30(45)33(52-34-31(46)28(43)23(41)13-48-34)35(51-26)50-25-12-19-21(39)10-18(37)11-24(19)49-32(25)16-4-7-20(38)22(40)9-16/h1-12,23,26,28-31,33-35,41,43-46H,13-14H2,(H4-,36,37,38,39,40,42)/p+1/t23-,26-,28-,29+,30+,31+,33+,34+,35+/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=C/c1ccc(cc1)O)O)O)O[C@@H]1[C@@H]([C@H]([C@H](CO1)O)O)O)c1ccc(c(c1)O)O)O)O |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Adoxaceae | Sambucus canadensis | Ref. |
Plantae | Begoniaceae | Begonia spp. | Ref. |
Plantae | Cruciferae | Matthiola incana | Ref. |
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