| Name |
Maesasaponin VII1
(-)-Maesasaponin VII1 |
| Formula |
C66H102O29 |
| Mw |
1358.6506773 |
| CAS RN |
259869-31-3 |
| C_ID |
C00039709
, 
|
| InChIKey |
PCPFFDRQCBHOSV-PVNCYBEDNA-N |
| InChICode |
InChI=1S/C66H102O29/c1-13-26(3)53(81)92-50-51(93-54(82)27(4)14-2)66-34(22-60(50,6)7)65(95-59(66)84)20-16-33-62(10)18-17-35(61(8,9)32(62)15-19-63(33,11)64(65,12)23-36(66)85-28(5)69)88-58-49(86-30-21-29(24-67)37(70)40(73)38(30)71)46(45(78)47(90-58)52(79)80)89-57-48(42(75)39(72)31(25-68)87-57)91-56-44(77)41(74)43(76)55(83)94-56/h13-14,29-51,55-59,67-68,70-78,83-84H,15-25H2,1-12H3,(H,79,80)/b26-13-,27-14-/t29-,30-,31-,32+,33-,34+,35+,36-,37+,38-,39+,40+,41-,42+,43-,44-,45+,46+,47+,48-,49-,50+,51+,55-,56-,57+,58-,59+,62+,63-,64+,65+,66-/m1/s1 |
| SMILES |
[C@@H]1(O)[C@@]23[C@@H](CC([C@H]([C@@H]2OC(=O)/C(=C\C)/C)OC(=O)/C(=C\C)/C)(C)C)[C@@]2([C@@](C[C@H]3OC(=O)C)([C@]3([C@H](CC2)[C@@]2([C@@H](CC3)C([C@H](CC2)O[C@@H]2O[C@@H]([C@H]([C@@H]([C@H]2O[C@H]2[C@H]([C@H]([C@H]([C@H](C2)CO)O)O)O)O[C@H]2[C@H](O[C@H]3[C@@H]([C@@H]([C@H]([C@@H](O3)O)O)O)O)[C@H]([C@H]([C@H](O2)CO)O)O)O)C(=O)O)(C)C)C)C)C)O1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Maesaceae | Maesa lanceolata  | Ref. |
|
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