input word = C00046781

Metabolite InformationStructural formula
Name Isomalyngamide A
(-)-Isomalyngamide A
Formula C29H45ClN2O6
Mw 552.29661489
CAS RN 312612-82-1
C_ID C00046781 ,
InChIKey MCGPGUSLTPAGCR-ZQSSIEDWNA-N
InChICode InChI=1S/C29H45ClN2O6/c1-6-7-8-9-11-14-24(36-3)15-12-10-13-16-27(33)31(2)21-23(20-30)17-25(37-4)18-28(34)32-22-26(38-5)19-29(32)35/h10,12,18-20,24H,6-9,11,13-17,21-22H2,1-5H3/b12-10+,23-20-,25-18+/t24-/m0/s1
SMILES C1(=O)C=C(CN1C(=O)/C=C(/C/C(=C/Cl)/CN(C(=O)CC/C=C/C[C@H](CCCCCCC)OC)C)\OC)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala
Organism
Kingdom Family Species Reference
--Lyngbya majuscula Ref.
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