| Stereochemistry | ABSOLUTE |
| Molecular Formula | C30H36O9 |
| Molecular Weight | 540.6014 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 9 / 9 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC(=O)C[C@H]1[C@@]2(C)[C@H](O[C@@H]3C[C@@H](C4=COC=C4)C(C)=C23)[C@H](OC(C)=O)[C@H]5[C@@](C)(C=CC(=O)[C@]15C)C(=O)OC
InChI
InChIKey=NHOIBRJOQAYBJT-IMGVWCFESA-N
InChI=1S/C30H36O9/c1-15-18(17-9-11-37-14-17)12-19-23(15)30(5)20(13-22(33)35-6)29(4)21(32)8-10-28(3,27(34)36-7)25(29)24(26(30)39-19)38-16(2)31/h8-11,14,18-20,24-26H,12-13H2,1-7H3/t18-,19-,20-,24-,25+,26-,28-,29+,30-/m1/s1
Nimbin is the active compound from the neem leaf extract which is now being tested in silico as a potential remedy against tuberculosis and dengue virus. Recent studies have shown that the drug interacts with NS2B-NS3 protease from dengue virus and fatty acid synthase of Mycobacterium tuberculosis. Nimbin can also be used as a pesticide.
CNS Activity
Approval Year
PubMed
Patents
SUBSTANCE RECORD
