input word = C00017627

Metabolite InformationStructural formula
Name Antibiotic MG 398HF9A
Octacosamicin A
Formula C31H52N4O9
Mw 624.37342929
CAS RN 122005-25-8
C_ID C00017627 ,
InChIKey JHJDTYDBQYAKEF-UHFFFAOYNA-N
InChICode InChI=1S/C31H52N4O9/c32-31(33)35(44)20-16-12-8-4-7-10-14-18-24(36)17-13-9-5-2-1-3-6-11-15-19-25(37)21-26(38)22-27(39)29(42)30(43)34-23-28(40)41/h1-3,5,7,10,14,18,25-27,29,37-39,42,44H,4,6,8-9,11-13,15-17,19-23H2,(H3,32,33)(H,34,43)(H,40,41)/b3-1+,5-2+,10-7+,18-14-/t25-,26-,27+,29+/m0/s1
SMILES N=C(N)N(O)CCCCCC=CC=CC(=O)CCCC=CC=CCCCCC(O)CC(O)CC(O)C(O)C(=O)NCC(=O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala L-Asp
Organism
Kingdom Family Species Reference
BacteriaPseudonocardiaceaeAmycolatopsis MG398-hF9 Ref.
zoom in



OrganismAmycolatopsis MG398-hF9
ReferenceDobashi,J.Antibiotics,41,(1988),1525