| Name |
Gypsophilinoside |
| Formula |
C36H56O13S |
| Mw |
728.34416261 |
| CAS RN |
947150-88-1 |
| C_ID |
C00030450
, 
|
| InChIKey |
SVHXPGBVKSURAG-GDLVENNSNA-N |
| InChICode |
InChI=1S/C36H56O13S/c1-18(2)20-12-14-36(31(43)48-29-28(40)27(39)26(38)23(17-37)47-29)16-15-33(4)24(35(20,36)6)9-8-21-19-7-10-25(49-50(44,45)46)34(5,30(41)42)22(19)11-13-32(21,33)3/h19-29,37-40H,1,7-17H2,2-6H3,(H,41,42)(H,44,45,46)/t19-,20+,21-,22-,23-,24+,25+,26-,27+,28-,29+,32-,33-,34+,35+,36-/m1/s1 |
| SMILES |
C=C(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@H](CC[C@@H]4[C@H]5CC[C@H](OS(=O)(=O)O)[C@@](C)(C(=O)O)[C@@H]5CC[C@]43C)[C@@]12C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Caryophyllaceae | Gypsophila repens | Ref. |
|
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