| Name |
Sempervirenoside A |
| Formula |
C42H52O21 |
| Mw |
892.30010873 |
| CAS RN |
124862-71-1 |
| C_ID |
C00006058
, 
|
| InChIKey |
NKJJMKATLZNGPP-KBUPGTNBNA-N |
| InChICode |
InChI=1S/C42H52O21/c1-16(2)7-12-22-25(59-41-31(51)30(50)28(48)26(14-43)60-41)13-23(46)27-29(49)38(35(61-36(22)27)20-8-10-21(54-6)11-9-20)63-42-33(53)39(34(17(3)56-42)57-18(4)44)62-40-32(52)37(58-19(5)45)24(47)15-55-40/h7-11,13,17,24,26,28,30-34,37,39-43,46-48,50-53H,12,14-15H2,1-6H3/t17-,24+,26-,28+,30-,31+,32-,33-,34-,37+,39+,40-,41+,42-/m0/s1 |
| SMILES |
COc1ccc(-c2oc3c(CC=C(C)C)c(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)cc(O)c3c(=O)c2O[C@@H]2OC(C)[C@H](OC(C)=O)C(O[C@@H]3OC[C@@H](O)[C@H](OC(C)=O)C3O)[C@@H]2O)cc1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Berberidaceae | Epimedium sempervirens | Ref. |
|
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