input word = C00015180

Metabolite InformationStructural formula
Name Isomigrastatin
Formula C27H39NO7
Mw 489.27265261
CAS RN 415952-70-4
C_ID C00015180 ,
InChIKey TYTDEHCAAKKYOG-FCWMPFOVNA-N
InChICode InChI=1S/C27H39NO7/c1-17(21(29)11-9-10-20-15-23(30)28-24(31)16-20)14-18(2)27-19(3)26(33)22(34-4)12-7-5-6-8-13-25(32)35-27/h7-8,12-14,17,19-20,22,26-27,33H,5-6,9-11,15-16H2,1-4H3,(H,28,30,31)/b12-7+,13-8+,18-14+/t17-,19+,22-,26-,27+/m0/s1
SMILES [C@H]1([C@@H]([C@@H]([C@H](/C=C/CC/C=C/C(=O)O1)OC)O)C)/C(=C/[C@@H](C(=O)CCCC1CC(=O)NC(=O)C1)C)/C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces platensis NRRL 18993 Ref.
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