| Name |
3'-O-beta-D-glucopyranosylcalactin
(+)-3'-O-beta-D-glucopyranosylcalactin |
| Formula |
C35H50O14 |
| Mw |
694.32005631 |
| CAS RN |
912539-80-1 |
| C_ID |
C00041275
, 
|
| InChIKey |
QHTLPWXBPOENQB-UIMSWHDWNA-N |
| InChICode |
InChI=1S/C35H50O14/c1-16-9-25(48-30-29(41)28(40)27(39)24(13-36)46-30)35(43)31(45-16)47-22-11-18-3-4-21-20(33(18,15-37)12-23(22)49-35)5-7-32(2)19(6-8-34(21,32)42)17-10-26(38)44-14-17/h10,15-16,18-25,27-31,36,39-43H,3-9,11-14H2,1-2H3/t16-,18+,19-,20+,21-,22-,23-,24-,25-,27-,28+,29-,30+,31+,32-,33-,34+,35+/m1/s1 |
| SMILES |
C[C@@H]1C[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@]2(O)O[C@@H]3C[C@@]4(C=O)[C@@H](CC[C@@H]5[C@@H]4CC[C@]4(C)[C@@H](C6=CC(=O)OC6)CC[C@]54O)C[C@H]3O[C@@H]2O1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Apocynaceae | Pergularia tomentosa  | Ref. |
|
|
zoom in
| Organism | Pergularia tomentosa |
|---|
| Reference | Hamed,J.Nat.Prod.,69,(2006),1319 |
|---|
|
