| Name |
(2beta,3beta,4alpha)-3-[(O-6-Deoxy-alpha-L-mannopyranosyl-(1->2)-O-beta-D-glucopyranosyl-(1->2)-beta-D-glucopyranosyl)oxy]-2-hydroxyolean-12-ene-23,28-dioic acid |
| Formula |
C48H76O20 |
| Mw |
972.49299487 |
| CAS RN |
242470-89-9 |
| C_ID |
C00061023
|
| InChIKey |
ZMLCRZDVQZQUGR-GRUYDJROSA-N |
| InChICode |
InChI=1S/C48H76O20/c1-20-28(52)31(55)34(58)38(63-20)66-35-32(56)29(53)24(18-49)64-39(35)67-36-33(57)30(54)25(19-50)65-40(36)68-37-23(51)17-44(4)26-9-8-21-22-16-43(2,3)12-14-48(22,42(61)62)15-13-45(21,5)46(26,6)11-10-27(44)47(37,7)41(59)60/h8,20,22-40,49-58H,9-19H2,1-7H3,(H,59,60)(H,61,62)/t20-,22-,23-,24+,25+,26+,27+,28-,29+,30+,31+,32-,33-,34+,35+,36+,37-,38-,39-,40-,44+,45+,46+,47-,48-/m0/s1 |
| SMILES |
CC1OC(OC2C(OC3C(OC4C(O)CC5(C)C(CCC6(C)C5CC=C5C7CC(C)(C)CCC7(C(=O)O)CCC56C)C4(C)C(=O)O)OC(CO)C(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Fabaceae | Medicago sativa  | Ref. |
|
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