| Name |
Quercetin 3-(3'',6''-di-p-coumarylglucoside) |
| Formula |
C39H32O16 |
| Mw |
756.16903498 |
| CAS RN |
72691-78-2 |
| C_ID |
C00005963
, 
|
| InChIKey |
RMWPNUYFHAPTBJ-UOPWYLIONA-N |
| InChICode |
InChI=1S/C39H32O16/c40-22-8-1-19(2-9-22)5-13-30(46)51-18-29-33(48)37(54-31(47)14-6-20-3-10-23(41)11-4-20)35(50)39(53-29)55-38-34(49)32-27(45)16-24(42)17-28(32)52-36(38)21-7-12-25(43)26(44)15-21/h1-17,29,33,35,37,39-45,48,50H,18H2/b13-5+,14-6+/t29-,33-,35-,37-,39+/m1/s1 |
| SMILES |
O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)C(O)C(OC(=O)/C=C/c2ccc(O)cc2)[C@@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Pinaceae | Pinus sylvestris  | Ref. |
|
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