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CHEBI:213171 - Verticilactam

ChEBI IDCHEBI:213171
ChEBI NameVerticilactam
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SubmitterMetaboLights
DownloadsMolfile
FormulaC25H33NO5
Net Charge0
Average Mass427.541
Monoisotopic Mass427.23587
SMILESC/C1=C\C=C/C=C/C(C)CNC(=O)CC(=O)CC2O[C@@H]3[C@H]4[C@H](C=C[C@@H]1[C@H]24)[C@H](O)C[C@@H]3O
InChIInChI=1S/C25H33NO5/c1-14-6-4-3-5-7-15(2)17-8-9-18-19(28)12-20(29)25-24(18)23(17)21(31-25)10-16(27)11-22(30)26-13-14/h3-9,14,17-21,23-25,28-29H,10-13H2,1-2H3,(H,26,30)/b5-3-,6-4+,15-7+/t14?,17-,18+,19+,20-,21?,23+,24-,25-/m0/s1
InChIKeyQPYKFWDFFXJDAQ-LYVLCPQRSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (20845980)
ChEBI Ontology
Outgoing Relation(s)
Verticilactam (CHEBI:213171) is a azamacrocycle (CHEBI:52898)
Verticilactam (CHEBI:213171) is a keratan 6'-sulfate (CHEBI:18331)
IUPAC Name 
(1R,2S,4R,5S,8R,9E,11Z,13E,22S,23S,24S)-2,4-dihydroxy-9,15-dimethyl-25-oxa-17-azatetracyclo[20.2.1.05,24.08,23]pentacosa-6,9,11,13-tetraene-18,20-dione
Manual XrefsDatabases
78438562ChemSpider