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CHEBI:203531 - Lysobacteramide B

ChEBI IDCHEBI:203531
ChEBI NameLysobacteramide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H42N2O5
Net Charge0
Average Mass510.675
Monoisotopic Mass510.30937
SMILESCC[C@@H]1C[C@H]2C[C@H]3[C@@H]4C/C=C\C(=O)NCCC[C@H]5C(=O)C(=C(O)/C=C/[C@H]4C[C@@H](O)[C@@H]3[C@H]2[C@@H]1C)C(=O)N5C
InChIInChI=1S/C30H42N2O5/c1-4-17-13-19-14-21-20-7-5-9-25(35)31-12-6-8-22-29(36)28(30(37)32(22)3)23(33)11-10-18(20)15-24(34)27(21)26(19)16(17)2/h5,9-11,16-22,24,26-27,33-34H,4,6-8,12-15H2,1-3H3,(H,31,35)/b9-5-,11-10+,28-23?/t16-,17-,18+,19+,20-,21+,22+,24-,26+,27-/m1/s1
InChIKeyJHDJBJVGZNOICT-HZGQBXKISA-N
Species of MetaboliteComponentSourceComments
Lysobacter enzymogenes (ncbitaxon:69) - PubMed (26200218)
ChEBI Ontology
Outgoing Relation(s)
Lysobacteramide B (CHEBI:203531) is a azamacrocycle (CHEBI:52898)
Lysobacteramide B (CHEBI:203531) is a keratan 6'-sulfate (CHEBI:18331)
IUPAC Name 
(3E,5R,7R,8S,9R,10R,11R,13S,15S,16R,18Z,25S)-11-ethyl-2,7-dihydroxy-10,26-dimethyl-21,26-diazapentacyclo[23.2.1.05,16.08,15.09,13]octacosa-1,3,18-triene-20,27,28-trione