| Name |
Anasteroside A |
| Formula |
C62H102O32S |
| Mw |
1390.6074919 |
| CAS RN |
402490-50-0 |
| C_ID |
C00045221
, 
|
| InChIKey |
OYUARXHQXRTSPL-FALKRMEBNA-N |
| InChICode |
InChI=1S/C62H102O32S/c1-22(2)15-27(65)16-23(3)30-9-10-31-29-18-34(33-17-28(94-95(79,80)81)11-13-62(33,8)32(29)12-14-61(30,31)7)86-57-49(77)52(40(68)25(5)84-57)91-59-53(92-55-47(75)44(72)38(66)24(4)83-55)43(71)37(21-82-59)89-60-54(46(74)42(70)36(20-64)88-60)93-58-50(78)51(39(67)26(6)85-58)90-56-48(76)45(73)41(69)35(19-63)87-56/h12,22-26,28-31,33-60,63-64,66-78H,9-11,13-21H2,1-8H3,(H,79,80,81)/t23-,24-,25-,26-,28+,29+,30-,31+,33-,34+,35-,36-,37-,38-,39-,40-,41+,42+,43+,44+,45+,46+,47-,48-,49-,50-,51+,52+,53-,54-,55+,56+,57+,58+,59+,60+,61-,62-/m1/s1 |
| SMILES |
CC(C)CC(=O)C[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C[C@H](O[C@@H]4O[C@H](C)[C@@H](O)[C@H](O[C@@H]5OC[C@@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](C)C(O)[C@H](O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O)[C@H]7O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](C)[C@@H](O)[C@H](O)[C@H]5O)[C@H]4O)[C@H]4C[C@@H](OS(=O)(=O)O)CC[C@]4(C)C3=CC[C@]12C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Animalia | Asteriidae | Anasterias minuta | Ref. |
|
|
zoom in
| Organism | Anasterias minuta |
|---|
| Reference | Chludil,J.Nat.Prod.,65,(2002),153 |
|---|
|
