| 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 |
C1[C@@H]2[C@](CCC1(C)C)(CC[C@@]1(C2=CC[C@H]2[C@]1(CC[C@@H]1[C@@]2(C[C@@H]([C@@H]([C@@]1(C)CO)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)O)C)C)C)C(=O)O[C@@H]1OC[C@@H]([C@H]([C@@H]1O[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)O)O)O[C@@H]1OC[C@@H]([C@@H]([C@H]1O)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Physenaceae | Physena sessiliflora  | Ref. |
|
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