| Name |
5-[[6-O-(2-Carboxyacetyl)-beta-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-3-[[6-O-[(2E)-3-[4-(beta-D-glucopyranosyloxy)phenyl]-1-oxo-2-propen-1-yl]-2-O-[2-O-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxo-2-propen-1-yl]-beta-D-xylopyranosyl]-beta-D-glucopyranosyl]oxy]-7-hydroxy-1-benzopyrylium |
| Formula |
C61H67O34 |
| Mw |
1343.3513743 |
| CAS RN |
475163-04-3 |
| C_ID |
C00061881
|
| InChIKey |
QRNIDVBVORPNBX-YYZQHOFDSA-O |
| InChICode |
InChI=1S/C61H66O34/c1-82-35-13-25(14-36(83-2)46(35)73)6-12-43(70)94-56-45(72)32(66)21-86-60(56)95-57-52(79)49(76)40(22-84-42(69)11-5-24-3-8-28(9-4-24)87-58-53(80)50(77)47(74)38(20-62)91-58)93-61(57)90-37-18-29-33(88-55(37)26-7-10-30(64)31(65)15-26)16-27(63)17-34(29)89-59-54(81)51(78)48(75)39(92-59)23-85-44(71)19-41(67)68/h3-18,32,38-40,45,47-54,56-62,66,72,74-81H,19-23H2,1-2H3,(H4-,63,64,65,67,68,70,73)/p+1/b11-5+/t32-,38-,39-,40-,45+,47-,48-,49-,50+,51+,52+,53-,54-,56-,57-,58-,59-,60+,61-/m1/s1 |
| SMILES |
COc1cc(C=CC(=O)OC2C(OC3C(Oc4cc5c(OC6OC(COC(=O)CC(=O)O)C(O)C(O)C6O)cc(O)cc5[o+]c4-c4ccc(O)c(O)c4)OC(COC(=O)C=Cc4ccc(OC5OC(CO)C(O)C(O)C5O)cc4)C(O)C3O)OCC(O)C2O)cc(OC)c1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Cruciferae | Arabidopsis thaliana | Ref. |
|
|
zoom in
| Organism | Arabidopsis thaliana |
|---|
| Reference | https://doi.org/10.1016/S0031-9422(01)00460-5 |
|---|
|
