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CHEBI:210505 - Neolymphostin B

ChEBI IDCHEBI:210505
ChEBI NameNeolymphostin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC17H16N4O3
Net Charge0
Average Mass324.340
Monoisotopic Mass324.12224
SMILESCCC(=O)Nc1cc(=N)c2ncc3cc(C(=O)C=COC)nc1c32
InChIInChI=1S/C17H16N4O3/c1-3-14(23)20-12-7-10(18)16-15-9(8-19-16)6-11(21-17(12)15)13(22)4-5-24-2/h4-8,18,21H,3H2,1-2H3,(H,20,23)
InChIKeyXYNRTRHNQGKROF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Salinispora arenicola CNS-205 (ncbitaxon:391037) - PubMed (21815669)
ChEBI Ontology
Outgoing Relation(s)
Neolymphostin B (CHEBI:210505) is a pyrroloquinoline (CHEBI:50918)
IUPAC Name 
N-[11-imino-6-(3-methoxyprop-2-enoyl)-2,7-diazatricyclo[6.3.1.04,12]dodeca-1,3,5,8(12),9-pentaen-9-yl]propanamide
Manual XrefsDatabases
78435529ChemSpider