| Name |
Physenoside S1
(+)-Physenoside S1 |
| Formula |
C57H92O26 |
| Mw |
1192.58768311 |
| CAS RN |
1191300-09-0 |
| C_ID |
C00048506
, 
|
| InChIKey |
YFDMVBRIHAEULM-ONOQZDITNA-N |
| InChICode |
InChI=1S/C57H92O26/c1-23-42(79-46-38(69)33(64)27(61)19-74-46)37(68)41(72)48(77-23)81-44-43(80-47-39(70)34(65)28(62)20-75-47)29(63)21-76-50(44)83-51(73)57-14-12-52(2,3)16-25(57)24-8-9-32-53(4)17-26(60)45(82-49-40(71)36(67)35(66)30(18-58)78-49)54(5,22-59)31(53)10-11-56(32,7)55(24,6)13-15-57/h8,23,25-50,58-72H,9-22H2,1-7H3/t23-,25-,26-,27+,28-,29-,30+,31+,32+,33-,34-,35+,36-,37-,38+,39+,40+,41+,42-,43+,44-,45-,46-,47-,48-,49-,50-,53-,54-,55+,56+,57-/m0/s1 |
| SMILES |
C[C@@H]1O[C@@H](O[C@H]2[C@H](OC(=O)[C@]34CCC(C)(C)C[C@H]3C3=CC[C@@H]5[C@@]6(C)C[C@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@](C)(CO)[C@@H]6CC[C@@]5(C)[C@]3(C)CC4)OC[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[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Physenaceae | Physena sessiliflora  | Ref. |
|
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