input word = C00060216

Metabolite InformationStructural formula
Name Indicalilacol D
Formula C30H44O5
Mw 484.31887452
CAS RN 1622077-10-4
C_ID C00060216
InChIKey MFHGCEAIYNXDSO-PSNDOJJLSA-N
InChICode InChI=1S/C30H44O5/c1-26(2,34)13-8-9-17-24-20(35-25(17)33)16-29(6)18-10-11-21-27(3,4)22(31)12-14-28(21,5)19(18)15-23(32)30(24,29)7/h8,10,13,17,19-21,23-24,32,34H,9,11-12,14-16H2,1-7H3/b13-8+/t17-,19+,20+,21+,23-,24-,28-,29-,30+/m1/s1
SMILES CC(C)(O)C=CCC1C(=O)OC2CC3(C)C4=CCC5C(C)(C)C(=O)CCC5(C)C4CC(O)C3(C)C21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAzadirachta indica Ref.
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