input word = C00053432

Metabolite InformationStructural formula
Name limocin A
Formula C29H42O5
Mw 470.30322445
CAS RN 135203-42-8
C_ID C00053432
InChIKey AVHQACOEJHCDEU-UJSLQPOYSA-N
InChICode InChI=1S/C29H42O5/c1-17(30)34-24-16-22-26(2,3)23(31)11-14-28(22,5)21-10-13-27(4)19(8-9-20(27)29(21,24)6)18-12-15-33-25(18)32-7/h9,11,14,18-19,21-22,24-25H,8,10,12-13,15-16H2,1-7H3/t18-,19+,21-,22+,24-,25+,27+,28-,29+/m1/s1
SMILES CO[C@H]1OCC[C@@H]1[C@@H]1CC=C2[C@@]3(C)[C@H](CC[C@]21C)[C@@]1(C)C=CC(=O)C(C)(C)[C@@H]1C[C@H]3OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAzadirachta indica Ref.
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