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CHEBI:197568 - Lajollamycin

ChEBI IDCHEBI:197568
ChEBI NameLajollamycin
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SubmitterMetaboLights
DownloadsMolfile
FormulaC36H53N3O10
Net Charge0
Average Mass687.831
Monoisotopic Mass687.37309
SMILESCOC(CC(C)C(O)/C=C/C=C/CNC(=O)C(C)(C)C(O)/C(C)=C\C=C/C=C/C(C)=C(\C)[N+](=O)[O-])C1(O)C(C)C(=O)N(C)C12C(=O)OC2C
InChIInChI=1S/C36H53N3O10/c1-22(26(5)39(46)47)17-13-11-14-18-23(2)30(41)34(7,8)32(43)37-20-16-12-15-19-28(40)24(3)21-29(48-10)36(45)25(4)31(42)38(9)35(36)27(6)49-33(35)44/h11-19,24-25,27-30,40-41,45H,20-21H2,1-10H3,(H,37,43)/b14-11-,16-12+,17-13+,19-15+,23-18-,26-22+
InChIKeyNSTDWVVCICGULY-RLJWGYAPSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (15730252)
ChEBI Ontology
Outgoing Relation(s)
Lajollamycin (CHEBI:197568) has functional parent α-amino acid (CHEBI:33704)
Lajollamycin (CHEBI:197568) is a organonitrogen compound (CHEBI:35352)
Lajollamycin (CHEBI:197568) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(4Z,6Z,8E,10E)-3-hydroxy-N-[(2E,4E)-6-hydroxy-9-(8-hydroxy-1,5,7-trimethyl-3,6-dioxo-2-oxa-5-azaspiro[3.4]octan-8-yl)-9-methoxy-7-methylnona-2,4-dienyl]-2,2,4,10-tetramethyl-11-nitrododeca-4,6,8,10-tetraenamide
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