| Name |
Pedunculoside
(+)-Pedunculoside |
| Formula |
C36H58O10 |
| Mw |
650.40299807 |
| CAS RN |
42719-32-4 |
| C_ID |
C00048048
, 
|
| InChIKey |
LARPFJIXBULVPK-ZUOWAKMDNA-N |
| InChICode |
InChI=1S/C36H58O10/c1-19-9-14-36(30(43)46-29-27(42)26(41)25(40)21(17-37)45-29)16-15-33(4)20(28(36)35(19,6)44)7-8-23-31(2)12-11-24(39)32(3,18-38)22(31)10-13-34(23,33)5/h7,19,21-29,37-42,44H,8-18H2,1-6H3/t19-,21-,22-,23-,24+,25-,26+,27-,28-,29+,31-,32+,33-,34-,35-,36+/m1/s1 |
| SMILES |
C[C@@H]1CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2[C@]1(C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Aquifoliaceae | Ilex integra | Ref. |
| Plantae | Aquifoliaceae | Ilex pedunculosa | Ref. |
| Plantae | Aquifoliaceae | Ilex rotunda  | Ref. |
| Plantae | Nitrariaceae | Peganum harmala | Ref. |
| Plantae | Rosaceae | Rubus ellipticus var.obcordatus | Ref. |
| Plantae | Theaceae/Pentaphylacaceae/Ternstroemiaceae | Adinandra nitida | Ref. |
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