| Name |
Mi-saponin C |
| Formula |
C64H104O32 |
| Mw |
1384.65107123 |
| CAS RN |
54327-11-6 |
| C_ID |
C00046828
, 
|
| InChIKey |
MVARPWMMYRSKND-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C64H104O32/c1-23-34(71)38(75)42(79)53(87-23)93-48-32(91-55-43(80)39(76)36(73)30(18-65)89-55)21-86-52(46(48)83)92-47-24(2)88-54(45(82)41(47)78)94-49-35(72)29(70)20-85-57(49)96-58(84)64-13-11-59(3,4)15-26(64)25-9-10-33-60(5)16-28(69)51(95-56-44(81)40(77)37(74)31(19-66)90-56)61(6,22-67)50(60)27(68)17-63(33,8)62(25,7)12-14-64/h9,23-24,26-57,65-83H,10-22H2,1-8H3/t23-,24+,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-,52+,53-,54-,55-,56-,57+,60+,61-,62+,63+,64+/m0/s1 |
| SMILES |
[C@H]1([C@H]([C@H]([C@@H]([C@@H](O1)O[C@H]1[C@H](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]1[C@@H]([C@H]([C@H]([C@H](O1)C)O[C@@H]1[C@@H]([C@H]([C@@H](CO1)O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)CO)O)O)O)O[C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O)O)O)O)O)C)C)O)C)O)O)O)O)CO |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Sapotaceae | Madhuca longifolia  | Ref. |
|
|
zoom in
|
