| Name |
Matesaponin 2 |
| Formula |
C53H86O21 |
| Mw |
1058.56615981 |
| CAS RN |
164178-27-2 |
| C_ID |
C00051504
|
| InChIKey |
ZGNBKNDOCCHRSM-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C53H86O21/c1-22-11-16-53(48(66)74-46-41(65)38(62)35(59)28(20-55)70-46)18-17-51(7)25(32(53)23(22)2)9-10-30-50(6)14-13-31(49(4,5)29(50)12-15-52(30,51)8)71-47-43(73-44-39(63)36(60)33(57)24(3)68-44)42(26(56)21-67-47)72-45-40(64)37(61)34(58)27(19-54)69-45/h9,22-24,26-47,54-65H,10-21H2,1-8H3 |
| SMILES |
CC1CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(OC7OC(CO)C(O)C(O)C7O)C6OC6OC(C)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Aquifoliaceae | Ilex paraguariensis  | Ref. |
|
|
zoom in
| Organism | Ilex paraguariensis |
|---|
| Reference | Xie, et al., Chinese Traditional and Herbal Drugs(Zhongcaoyao), 33, (2002), 85 |
|---|
|
