input word = C00042265

Metabolite InformationStructural formula
Name Azadirachtin O
(-)-Azadirachtin O
Formula C35H46O15
Mw 706.2836708
CAS RN 863408-52-0
C_ID C00042265 ,
InChIKey FZGPSVKDAHZKDU-XEVNDNHUNA-N
InChICode InChI=1S/C35H46O15/c1-15(2)10-21(37)48-18-12-19(47-16(3)36)33(28(40)43-7)14-45-22-25(33)32(18)13-46-23(27(39)42-6)24(32)30(4,26(22)38)35-20-11-17(31(35,5)50-35)34(41)8-9-44-29(34)49-20/h8-9,15,17-20,22-26,29,38,41H,10-14H2,1-7H3/t17-,18-,19-,20+,22-,23+,24+,25-,26-,29+,30+,31+,32-,33+,34+,35+/m1/s1
SMILES [C@H]1([C@H]2[C@@H]3[C@@]4([C@H]([C@@]1([C@]15[C@@]([C@@H]6[C@@]7([C@H](O[C@H]1C6)OC=C7)O)(C)O5)C)[C@H](OC4)C(=O)OC)[C@@H](C[C@H]([C@]3(CO2)C(=O)OC)OC(=O)C)OC(=O)CC(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAzadirachta excelsa Ref.
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