| Name |
Swietenitin J |
| Formula |
C43H56O19 |
| Mw |
876.34157961 |
| CAS RN |
1173892-12-0 |
| C_ID |
C00048172
, 
|
| InChIKey |
CKUCEZICWTXPGZ-RHZRMYFBNA-N |
| InChICode |
InChI=1S/C43H56O19/c1-13-40(52-12)58-31-41(62-40)30(55-32(49)35(7)21(2)56-35)33(5)20-39(41,57-23(4)45)36(8,25(33)16-27(47)50-10)42-26(46)17-34(6,29(54-22(3)44)24-14-15-53-19-24)38(18-28(48)51-11)43(31,42)61-37(9,59-38)60-42/h14-15,19,21,25-26,29-31,46H,13,16-18,20H2,1-12H3/t21-,25+,26-,29+,30+,31-,33-,34+,35+,36-,37-,38+,39-,40-,41+,42+,43+/m1/s1 |
| SMILES |
C(=O)(O[C@]12[C@@]3([C@]45[C@]6([C@H]7[C@@]1(O[C@@](O7)(OC)CC)[C@H]([C@]([C@@H]3CC(=O)OC)(C)C2)OC(=O)[C@@]1([C@H](O1)C)C)[C@@]([C@@](C[C@H]4O)([C@H](c1ccoc1)OC(=O)C)C)(CC(=O)OC)O[C@](O5)(O6)C)C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Meliaceae | Swietenia macrophylla  | Ref. |
|
|
zoom in
|
