| Name |
Saponoside A |
| Formula |
C54H84O25 |
| Mw |
1132.53016824 |
| CAS RN |
26151-14-4 |
| C_ID |
C00040212
, 
|
| InChIKey |
UHVCXQBCBRWVHQ-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C54H84O25/c1-49(2)13-15-54(48(71)79-47-40(68)41(77-45-38(66)34(62)31(59)25(19-56)74-45)32(60)26(75-47)20-72-44-37(65)33(61)30(58)24(18-55)73-44)16-14-52(5)22(23(54)17-49)7-8-28-50(3)11-10-29(51(4,21-57)27(50)9-12-53(28,52)6)76-46-39(67)35(63)36(64)42(78-46)43(69)70/h7,21,23-42,44-47,55-56,58-68H,8-20H2,1-6H3,(H,69,70)/t23-,24+,25-,26+,27-,28-,29+,30+,31-,32-,33+,34+,35-,36+,37-,38-,39+,40-,41-,42+,44-,45+,46+,47+,50+,51-,52-,53+,54-/m0/s1 |
| SMILES |
C1[C@H]([C@]([C@@H]2[C@@](C1)([C@H]1[C@@](CC2)([C@@]2(C(=CC1)[C@H]1[C@@](CC2)(CCC(C1)(C)C)C(=O)O[C@H]1O[C@@H]([C@@H]([C@@H]([C@@H]1O)O[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)CO)O)CO[C@H]1O[C@@H]([C@H]([C@H]([C@@H]1O)O)O)CO)C)C)C)(C=O)C)O[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)C(=O)O)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Caryophyllaceae | Saponaria officinalis  | Ref. |
| Plantae | Convallariaceae | Polygonatum multiflorum | Ref. |
|
|
zoom in
| Organism | Saponaria officinalis |
|---|
| Reference | Tan,Phytochem.,52,(1999),153 |
|---|
|
