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CHEBI:220306 - Pyrronamycin A

ChEBI IDCHEBI:220306
ChEBI NamePyrronamycin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H29N11O5
Net Charge0
Average Mass539.557
Monoisotopic Mass539.23531
SMILESN#CC(CC(=O)NC(C=O)C/C=C/CN)NC(=O)c1cc(NC(=O)c2cc(NC(=O)CN=C(N)N)cn2)cn1
InChIInChI=1S/C23H29N11O5/c24-4-2-1-3-13(12-35)31-19(36)7-14(8-25)33-21(38)18-6-16(10-29-18)34-22(39)17-5-15(9-28-17)32-20(37)11-30-23(26)27/h1-2,5-6,9-10,12-14,28-29H,3-4,7,11,24H2,(H,31,36)(H,32,37)(H,33,38)(H,34,39)(H4,26,27,30)/b2-1+
InChIKeyUNZNMERRZITKPA-OWOJBTEDSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies (ncbitaxon:1931) - PubMed (10724011)
ChEBI Ontology
Outgoing Relation(s)
Pyrronamycin A (CHEBI:220306) is a amino acid amide (CHEBI:22475)
IUPAC Name 
N-[5-[[3-[[(E)-6-amino-1-oxohex-4-en-2-yl]amino]-1-cyano-3-oxopropyl]carbamoyl]-1H-pyrrol-3-yl]-4-[[2-(diaminomethylideneamino)acetyl]amino]-1H-pyrrole-2-carboxamide
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