CHEBI:218407 - Malonomicin

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Malonomicin
ChEBI ID CHEBI:218407
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H18N4O9
Net Charge 0
Average Mass 374.306
Monoisotopic Mass 374.10738
InChI InChI=1S/C13H18N4O9/c14-2-5-8(20)7(10(22)16-5)6(19)1-13(11(23)24,12(25)26)17-9(21)4(15)3-18/h4-5,18,20H,1-3,14-15H2,(H,16,22)(H,17,21)(H,23,24)(H,25,26)
InChIKey IPQOAJQXCZEYLK-UHFFFAOYSA-N
SMILES O=C1NC(CN)C(=C1C(=O)CC(NC(=O)C(N)CO)(C(=O)O)C(=O)O)O
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: DOI
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Malonomicin (CHEBI:218407) is a dipeptide (CHEBI:46761)
IUPAC Name
2-[(2-amino-3-hydroxypropanoyl)amino]-2-[2-[2-(aminomethyl)-3-hydroxy-5-oxo-1,2-dihydropyrrol-4-yl]-2-oxoethyl]propanedioic acid
Manual Xref Database
10254483 ChemSpider
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