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CHEBI:219547 - Colabomycin G

ChEBI IDCHEBI:219547
ChEBI NameColabomycin G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC31H34N2O7
Net Charge0
Average Mass546.620
Monoisotopic Mass546.23660
SMILESCC(C)C/C=C/C=C/C=C/C(=O)NC1=C[C@@](O)(/C=C/C=C/C=C/C=C/C(=O)NC2=C(O)CCC2=O)C2OC2C1=O
InChIInChI=1S/C31H34N2O7/c1-21(2)14-10-6-5-8-11-15-25(36)32-22-20-31(39,30-29(40-30)28(22)38)19-13-9-4-3-7-12-16-26(37)33-27-23(34)17-18-24(27)35/h3-13,15-16,19-21,29-30,34,39H,14,17-18H2,1-2H3,(H,32,36)(H,33,37)/b7-3+,8-5+,9-4+,10-6+,15-11+,16-12+,19-13+/t29?,30?,31-/m0/s1
InChIKeyAMIXCSMYTJCODG-MRZHYBPHSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (24838618)
ChEBI Ontology
Outgoing Relation(s)
Colabomycin G (CHEBI:219547) is a cyclohexenones (CHEBI:48953)
IUPAC Name 
(2E,4E,6E)-N-[(5S)-5-hydroxy-5-[(1E,3E,5E,7E)-9-[(2-hydroxy-5-oxocyclopenten-1-yl)amino]-9-oxonona-1,3,5,7-tetraenyl]-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]-9-methyldeca-2,4,6-trienamide
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78442838ChemSpider