| Name |
(3beta,4alpha)-3-[(O-4-O-Acetyl-alpha-L-idopyranosyl-(1->3)-O-6-deoxy-alpha-L-mannopyranosyl-(1->2)-alpha-L-arabinopyranosyl)oxy]-23-hydroxy-olean-12-en-28-oic acid |
| Formula |
C49H78O18 |
| Mw |
954.51881569 |
| CAS RN |
2361041-01-0 |
| C_ID |
C00060977
|
| InChIKey |
FHJNIQZCHCARAR-NTYMHOCBSA-N |
| InChICode |
InChI=1S/C49H78O18/c1-23-32(54)38(66-40-35(57)34(56)37(63-24(2)52)28(20-50)64-40)36(58)41(62-23)67-39-33(55)27(53)21-61-42(39)65-31-12-13-45(5)29(46(31,6)22-51)11-14-48(8)30(45)10-9-25-26-19-44(3,4)15-17-49(26,43(59)60)18-16-47(25,48)7/h9,23,26-42,50-51,53-58H,10-22H2,1-8H3,(H,59,60)/t23-,26-,27-,28-,29+,30+,31-,32-,33-,34+,35+,36+,37+,38+,39+,40-,41-,42-,45-,46-,47+,48+,49-/m0/s1 |
| SMILES |
CC(=O)OC1C(CO)OC(OC2C(O)C(C)OC(OC3C(OC4CCC5(C)C(CCC6(C)C5CC=C5C7CC(C)(C)CCC7(C(=O)O)CCC56C)C4(C)CO)OCC(O)C3O)C2O)C(O)C1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Sapindaceae | Sapindus mukorossi  | Ref. |
|
|
zoom in
| Organism | Sapindus mukorossi |
|---|
| Reference | https://doi.org/10.1080/14786419.2019.1577837 |
|---|
|
