| Name |
(3beta,4alpha,22beta)-22-[[2-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-23-hydroxyolean-12-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1->2)-O-beta-D-galactopyranosyl-(1->2)-beta-D-glucopyranosiduronic acid |
| Formula |
C60H98O27 |
| Mw |
1250.62954793 |
| CAS RN |
441045-44-9 |
| C_ID |
C00019001
, 
|
| InChIKey |
GMIGRWUYBKCOSQ-DSWQABFRNA-N |
| InChICode |
InChI=1S/C60H98O27/c1-23-33(64)37(68)43(74)50(78-23)85-46-39(70)35(66)27(20-61)80-52(46)83-32-19-55(3,4)18-26-25-10-11-30-57(6)14-13-31(58(7,22-63)29(57)12-15-60(30,9)59(25,8)17-16-56(26,32)5)82-54-48(42(73)41(72)45(84-54)49(76)77)87-53-47(40(71)36(67)28(21-62)81-53)86-51-44(75)38(69)34(65)24(2)79-51/h10,23-24,26-48,50-54,61-75H,11-22H2,1-9H3,(H,76,77)/t23-,24-,26-,27-,28+,29+,30+,31-,32+,33-,34-,35-,36+,37+,38+,39-,40-,41-,42-,43-,44+,45-,46-,47+,48-,50-,51-,52-,53-,54+,56+,57-,58-,59+,60+/m0/s1 |
| SMILES |
CC1O[C@@H](OC2[C@H](O[C@@H]3CC(C)(C)CC4C5=CCC6[C@@]7(C)CC[C@H](O[C@@H]8OC(C(=O)O)[C@@H](O)[C@H](O)C8O[C@@H]8OC(CO)[C@H](O)[C@H](O)C8O[C@@H]8OC(C)[C@H](O)[C@@H](O)C8O)[C@@](C)(CO)C7CC[C@@]6(C)[C@]5(C)CC[C@]43C)OC(CO)[C@@H](O)[C@@H]2O)C(O)[C@H](O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Fabaceae | Glycine max  | Ref. |
|
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