| Name |
Quercetin 3-(6''-(E)-p-coumaroylsophoroside)-7-rhamnoside
7-[(6-Deoxy-alpha-L-mannopyranosyl)oxy]-2-(3,4-dihydroxyphenyl)-3-[[2-O-beta-D-glucopyranosyl-6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-beta-D-glucopyranosyl]oxy]-5-hydroxy-4H-1-benzopyran-4-one |
| Formula |
C42H46O23 |
| Mw |
918.24298778 |
| CAS RN |
342620-95-5 |
| C_ID |
C00013886
, 
|
| InChIKey |
YYBUGTDXSVDSBB-VCOYJWEONA-N |
| InChICode |
InChI=1S/C42H46O23/c1-15-28(49)32(53)35(56)40(59-15)60-19-11-22(47)27-23(12-19)61-37(17-5-8-20(45)21(46)10-17)38(31(27)52)64-42-39(65-41-36(57)33(54)29(50)24(13-43)62-41)34(55)30(51)25(63-42)14-58-26(48)9-4-16-2-6-18(44)7-3-16/h2-12,15,24-25,28-30,32-36,39-47,49-51,53-57H,13-14H2,1H3/b9-4+/t15-,24+,25-,28+,29-,30-,32-,33+,34+,35+,36+,39-,40+,41+,42+/m1/s1 |
| SMILES |
c1c(cc(c(c1)O)O)c1oc2c(c(=O)c1O[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]([C@@H](O1)CO)O)O)O)c(cc(c2)O[C@H]1[C@H]([C@@H]([C@H]([C@H](O1)C)O)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Ranunculaceae | Aconitum napellus  | Ref. |
|
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