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CHEBI:66535 - surugapyrrole B

ChEBI IDCHEBI:66535
ChEBI Namesurugapyrrole B
Stars
DefinitionA pyrrolecarboxamide obtained by the formal condensation of 1-hydroxy-1H-pyrrole-2-carboxylic acid with the amino group of 3-aminopropanoic acid. It is isolated from the culture broth of Streptomyces sp.USF-6280 and exhibits DPPH radical scavenging activity.
Last Modified17 October 2012
DownloadsMolfile
FormulaC8H10N2O4
Net Charge0
Average Mass198.178
Monoisotopic Mass198.06406
SMILESO=C(O)CCNC(=O)c1cccn1O
InChIInChI=1S/C8H10N2O4/c11-7(12)3-4-9-8(13)6-2-1-5-10(6)14/h1-2,5,14H,3-4H2,(H,9,13)(H,11,12)
InChIKeySYKRZHVRQXPZOX-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Streptomyces sp. (ncbitaxon:1931) - PubMed (19129624) Strain: USF 6280
Roles Classification
Chemical Roles:
radical scavenger  A role played by a substance that can react readily with, and thereby eliminate, radicals.
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
surugapyrrole B (CHEBI:66535) has role metabolite (CHEBI:25212)
surugapyrrole B (CHEBI:66535) has role radical scavenger (CHEBI:48578)
surugapyrrole B (CHEBI:66535) is a N-hydroxypyrrole (CHEBI:68839)
surugapyrrole B (CHEBI:66535) is a monocarboxylic acid (CHEBI:25384)
surugapyrrole B (CHEBI:66535) is a pyrrolecarboxamide (CHEBI:48611)
surugapyrrole B (CHEBI:66535) is a β-alanine derivative (CHEBI:22823)
IUPAC Name 
N-[(1-hydroxy-1H-pyrrol-2-yl)carbonyl]-β-alanine
Synonym  Source
3-{[(1-hydroxy-1H-pyrrol-2-yl)carbonyl]amino}propanoic acidIUPAC
Registry NumbersSources
Reaxys:19111079Reaxys
Citations