input word = C00036245

Metabolite InformationStructural formula
Name Zafaral
Formula C29H40O6
Mw 484.28248901
CAS RN 791855-21-5
C_ID C00036245 ,
InChIKey YNXQXJIXLIRWJC-SRGDHKKTNA-N
InChICode InChI=1S/C29H40O6/c1-9-17(15-30)22-18(32)14-20-27(22,5)12-10-19-28(6)13-11-21(33)26(3,4)24(28)23(34-8)25(29(19,20)7)35-16(2)31/h11,13-15,17,19,22-25H,9-10,12H2,1-8H3/t17-,19-,22-,23-,24-,25-,27-,28+,29-/m1/s1
SMILES CCC(C=O)[C@@H]1C(=O)C=C2[C@@]1(C)CC[C@@H]1C3(C)C=CC(=O)C(C)(C)[C@@H]3[C@@H](OC)C(OC(C)=O)[C@@]21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAzadirachta indica Ref.
--Azadiractica indica Ref.
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OrganismAzadirachta indica
ReferenceSiddiqui,Phytochem.,65,(2004),2363