input word = C00063808

Metabolite InformationStructural formula
Name Azadirachtin H
Formula C33H42O14
Mw 662.25745605
CAS RN 134788-15-1
C_ID C00063808
InChIKey ILMJTWSQVCYIKY-PEVUNLJASA-N
InChICode InChI=1S/C33H42O14/c1-7-14(2)24(36)45-17-11-18(44-15(3)34)31(26(38)40-6)13-42-20-21(31)30(17)12-43-25(37)22(30)28(4,23(20)35)33-19-10-16(29(33,5)47-33)32(39)8-9-41-27(32)46-19/h7-9,16-23,25,27,35,37,39H,10-13H2,1-6H3/b14-7+/t16-,17-,18+,19?,20+,21+,22-,23+,25+,27-,28-,29-,30?,31-,32-,33-/m0/s1
SMILES CC=C(C)C(=O)OC1CC(OC(C)=O)C2(C(=O)OC)COC3C2C12COC(O)C2C(C)(C12OC1(C)C1CC2OC2OC=CC21O)C3O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAzadirachta indica Ref.
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