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CHEBI:34814 - Leucomycin A4

ChEBI IDCHEBI:34814
ChEBI NameLeucomycin A4
Stars
Last Modified26 August 2015
DownloadsMolfile
FormulaC41H67NO15
Net Charge0
Average Mass813.979
Monoisotopic Mass813.45107
SMILESCCCC(=O)O[C@H]1[C@H](C)O[C@@H](O[C@H]2[C@H](N(C)C)[C@@H](O)[C@H](O[C@H]3[C@@H](CC=O)C[C@@H](C)[C@@H](O)/C=C/C=C/C[C@@H](C)OC(=O)C[C@@H](OC(C)=O)[C@@H]3OC)O[C@@H]2C)C[C@@]1(C)O
InChIInChI=1S/C41H67NO15/c1-11-15-31(46)55-39-26(5)52-33(22-41(39,7)49)56-36-25(4)53-40(35(48)34(36)42(8)9)57-37-28(18-19-43)20-23(2)29(45)17-14-12-13-16-24(3)51-32(47)21-30(38(37)50-10)54-27(6)44/h12-14,17,19,23-26,28-30,33-40,45,48-49H,11,15-16,18,20-22H2,1-10H3/b13-12+,17-14+/t23-,24-,25-,26+,28+,29+,30-,33+,34-,35-,36-,37+,38+,39+,40+,41-/m1/s1
InChIKeyXVTMRUKLMXPAKO-RXUUKHTDSA-N
ChEBI Ontology
Outgoing Relation(s)
Leucomycin A4 (CHEBI:34814) is a butyrate ester (CHEBI:50477)
Leucomycin A4 (CHEBI:34814) is a macrolide (CHEBI:25106)
Synonym  Source
Leucomycin A4KEGG COMPOUND
Manual XrefsDatabases
C14057KEGG COMPOUND
C00018742KNApSAcK
Registry NumbersSources
CAS:18361-46-1KEGG COMPOUND