| Name |
Malonylginsenoside Ra1 |
| Formula |
C61H100O29 |
| Mw |
1296.63502724 |
| CAS RN |
1646595-45-0 |
| C_ID |
C00060256
|
| InChIKey |
ICGATYTYOILYQX-DXSAALQNSA-N |
| InChICode |
InChI=1S/C61H100O29/c1-25(2)10-9-14-61(8,90-55-50(79)45(74)42(71)31(87-55)23-82-52-48(77)43(72)32(24-83-52)85-53-47(76)39(68)28(64)21-81-53)26-11-16-60(7)38(26)27(63)18-34-58(5)15-13-35(57(3,4)33(58)12-17-59(34,60)6)88-56-51(46(75)40(69)29(20-62)84-56)89-54-49(78)44(73)41(70)30(86-54)22-80-37(67)19-36(65)66/h10,26-35,38-56,62-64,68-79H,9,11-24H2,1-8H3,(H,65,66)/t26-,27+,28+,29+,30+,31+,32-,33-,34+,35-,38-,39-,40+,41+,42+,43-,44-,45-,46-,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,58-,59+,60+,61-/m0/s1 |
| SMILES |
CC(C)=CCCC(C)(OC1OC(COC2OCC(OC3OCC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4OC4OC(COC(=O)CC(=O)O)C(O)C(O)C4O)C(C)(C)C3CCC12C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Araliaceae | Panax ginseng  | Ref. |
|
|
zoom in
| Organism | Panax ginseng |
|---|
| Reference | https://doi.org/10.1016/j.jpba.2014.12.005
https://doi.org/10.1016/j.jpba.2014.12.030 |
|---|
|
