input word = C00060769

Metabolite InformationStructural formula
Name Azadiradionol
Formula C30H44O5
Mw 484.31887452
CAS RN 210103-52-9
C_ID C00060769
InChIKey CMRZGEHWMGLZNJ-FCJWWUNXSA-N
InChICode InChI=1S/C30H44O5/c1-17(9-10-18(2)31)26-20(33)15-23-29(26,7)13-11-21-28(6)14-12-24(34)27(4,5)22(28)16-25(30(21,23)8)35-19(3)32/h12,14-15,17-18,21-22,25-26,31H,9-11,13,16H2,1-8H3/t17?,18?,21-,22+,25-,26-,28-,29-,30-/m1/s1
SMILES CC(=O)OC1CC2C(C)(C)C(=O)C=CC2(C)C2CCC3(C)C(=CC(=O)C3C(C)CCC(C)O)C12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAzadirachta indica Ref.
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OrganismAzadirachta indica
Referencehttps://doi.org/10.1016/S0031-9422(97)00826-1