EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:174895 - Neuromedin B (1-3)

ChEBI IDCHEBI:174895
ChEBI NameNeuromedin B (1-3)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H22N4O5
Net Charge0
Average Mass302.331
Monoisotopic Mass302.15902
SMILESCC(C)C[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CN)C(=O)O
InChIInChI=1S/C12H22N4O5/c1-6(2)3-8(12(20)21)16-11(19)7(4-9(14)17)15-10(18)5-13/h6-8H,3-5,13H2,1-2H3,(H2,14,17)(H,15,18)(H,16,19)(H,20,21)/t7-,8+/m0/s1
InChIKeyJVWPPCWUDRJGAE-JGVFFNPUSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Neuromedin B (1-3) (CHEBI:174895) is a oligopeptide (CHEBI:25676)
IUPAC Name 
(2R)-2-[[(2S)-4-amino-2-[(2-aminoacetyl)amino]-4-oxobutanoyl]amino]-4-methylpentanoic acid
Manual XrefsDatabases
30776674ChemSpider
HMDB0013016HMDB