input word = C00058376

Metabolite InformationStructural formula
Name Azadirachtolide
Formula C33H46O8
Mw 570.31926845
CAS RN 198139-71-8
C_ID C00058376
InChIKey SIKLEZJEWHKJFN-ONKZMVTOSA-N
InChICode InChI=1S/C33H46O8/c1-17(2)12-26(36)41-24-14-23(40-18(3)34)31(5)16-39-27-28(31)33(24,7)22-10-11-30(4)20(19-13-25(35)38-15-19)8-9-21(30)32(22,6)29(27)37/h9,12,19-20,22-24,27-29,37H,8,10-11,13-16H2,1-7H3/t19-,20-,22-,23+,24-,27+,28-,29+,30-,31+,32-,33-/m0/s1
SMILES CC(=O)O[C@@H]1C[C@H](OC(=O)C=C(C)C)[C@@]2(C)[C@H]3[C@@H](OC[C@]13C)[C@@H](O)[C@@]1(C)C3=CC[C@@H]([C@@H]4COC(=O)C4)[C@]3(C)CC[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAzadirachta indica Ref.
zoom in