| Name |
Mi-saponin A |
| Formula |
C58H94O27 |
| Mw |
1222.5982478 |
| CAS RN |
54328-42-6 |
| C_ID |
C00046826
, 
|
| InChIKey |
CQUSHZSCDGSFBF-AWDPXYPANA-N |
| InChICode |
InChI=1S/C58H94O27/c1-22-32(65)35(68)38(71)48(78-22)82-43-29(64)20-76-47(41(43)74)81-42-23(2)79-49(40(73)37(42)70)83-44-33(66)28(63)19-77-51(44)85-52(75)58-13-11-53(3,4)15-25(58)24-9-10-31-54(5)16-27(62)46(84-50-39(72)36(69)34(67)30(18-59)80-50)55(6,21-60)45(54)26(61)17-57(31,8)56(24,7)12-14-58/h9,22-23,25-51,59-74H,10-21H2,1-8H3/t22-,23-,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-,51-,54+,55-,56+,57+,58-/m0/s1 |
| SMILES |
[C@@H]1([C@@H]([C@H]([C@@H](O[C@@H]1CO)O[C@H]1[C@@H](O)C[C@]2([C@H]([C@]1(C)CO)[C@@H](C[C@@]1([C@@H]2CC=C2[C@]1(CC[C@@]1([C@H]2CC(CC1)(C)C)C(=O)O[C@@H]1OC[C@H]([C@H]([C@H]1O[C@@H]1O[C@H]([C@H]([C@H]([C@H]1O)O)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O[C@@H]1O[C@H]([C@@H]([C@H]([C@H]1O)O)O)C)O)C)O)O)C)C)O)C)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Sapotaceae | Madhuca longifolia  | Ref. |
|
|
zoom in
| Organism | Madhuca longifolia |
|---|
| Reference | Yoshikawa,J.Nat.Prod.,63,(2000),1679 |
|---|
|
