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CHEBI:217097 - Pactamide G

ChEBI IDCHEBI:217097
ChEBI NamePactamide G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H40N2O6
Net Charge0
Average Mass512.647
Monoisotopic Mass512.28864
SMILESCC[C@@H]1C[C@]2(O)C[C@@H]3[C@H]4CC=CC(=O)NCCC[C@@H]5NC(=O)C(=C(O)C=C[C@@H]4C[C@H](O)[C@H]3[C@@H]2[C@H]1C)C5=O
InChIInChI=1S/C29H40N2O6/c1-3-16-13-29(37)14-19-18-6-4-8-23(34)30-11-5-7-20-27(35)25(28(36)31-20)21(32)10-9-17(18)12-22(33)24(19)26(29)15(16)2/h4,8-10,15-20,22,24,26,32-33,37H,3,5-7,11-14H2,1-2H3,(H,30,34)(H,31,36)/t15-,16+,17+,18-,19+,20-,22-,24-,26-,29-/m0/s1
InChIKeyKWVWGKPJXLBTAG-WVDCPNRKSA-N
Species of MetaboliteComponentSourceComments
Streptomyces griseus (ncbitaxon:1911) - PubMed (32052979)
ChEBI Ontology
Outgoing Relation(s)
Pactamide G (CHEBI:217097) is a azamacrocycle (CHEBI:52898)
Pactamide G (CHEBI:217097) is a keratan 6'-sulfate (CHEBI:18331)
IUPAC Name 
(5S,7S,8R,9S,10S,11R,13S,15R,16S,25S)-11-ethyl-2,7,13-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.05,16.08,15.09,13]octacosa-1,3,18-triene-20,27,28-trione