| Name |
Albiziasaponin E
(-)-Albiziasaponin E |
| Formula |
C53H80O24 |
| Mw |
1100.50395349 |
| CAS RN |
477567-72-9 |
| C_ID |
C00045628
, 
|
| InChIKey |
XKQFVUQOPLFZGL-PFNMLWFSNA-N |
| InChICode |
InChI=1S/C53H80O24/c1-20-28(56)30(58)34(62)44(70-20)77-40-36(73-43-33(61)29(57)23(55)18-69-43)35(63)38(42(66)67)75-46(40)76-39-32(60)31(59)37(41(64)65)74-45(39)71-26-11-12-50(4)24(51(26,5)19-54)10-13-53(7)25(50)9-8-21-22-16-48(2)17-27(72-47(48)68)49(22,3)14-15-52(21,53)6/h8,20,22-40,43-46,54-63H,9-19H2,1-7H3,(H,64,65)(H,66,67)/t20-,22?,23+,24+,25+,26-,27+,28-,29-,30+,31-,32-,33+,34+,35-,36-,37-,38-,39+,40+,43-,44-,45+,46-,48+,49+,50+,51+,52+,53+/m0/s1 |
| SMILES |
C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3[C@H](O[C@H]4CC[C@@]5(C)[C@@H](CC[C@]6(C)[C@@H]5CC=C5[C@@H]7C[C@]8(C)C[C@@H](OC8=O)[C@]7(C)CC[C@]56C)[C@@]4(C)CO)O[C@H](C(=O)O)[C@@H](O)[C@@H]3O)O[C@H](C(=O)O)[C@@H](O)[C@@H]2O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Fabaceae | Albizia myriophylla  | Ref. |
|
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