| Name |
Saponarioside M
(+)-Saponarioside M |
| Formula |
C53H84O24 |
| Mw |
1104.53525361 |
| CAS RN |
252737-18-1 |
| C_ID |
C00049750
, 
|
| InChIKey |
DSOVPWHTAYTWNB-FMLHZDPINA-N |
| InChICode |
InChI=1S/C53H84O24/c1-48(2)13-15-53(47(69)77-44-40(66)36(62)34(60)27(74-44)21-71-45-41(37(63)33(59)26(19-55)73-45)76-43-39(65)35(61)32(58)25(18-54)72-43)16-14-50(4)22(23(53)17-48)7-8-28-49(3)11-10-30(75-42-38(64)31(57)24(56)20-70-42)52(6,46(67)68)29(49)9-12-51(28,50)5/h7,23-45,54-66H,8-21H2,1-6H3,(H,67,68)/t23-,24+,25+,26+,27+,28+,29+,30-,31-,32+,33+,34+,35-,36-,37-,38+,39+,40+,41+,42-,43-,44-,45+,49+,50+,51+,52-,53-/m0/s1 |
| SMILES |
CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[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@@H]6OC[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(C(=O)O)[C@@H]5CC[C@]43C)[C@@H]2C1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Caryophyllaceae | Saponaria officinalis  | Ref. |
|
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