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CHEBI:193005 - neoechinulin B (anion)

ChEBI IDCHEBI:193005
ChEBI Nameneoechinulin B (anion)
Stars
DefinitionMajor microspecies at pH 7.3.
SubmitterAnne Morgat
DownloadsMolfile
FormulaC19H18N3O2
Net Charge-1
Average Mass320.372
Monoisotopic Mass320.14045
SMILESC=CC(C)(C)c1nc2ccccc2c1/C=c1/[n-]c(=O)c(=C)nc1=O
InChIInChI=1S/C19H19N3O2/c1-5-19(3,4)16-13(12-8-6-7-9-14(12)21-16)10-15-18(24)20-11(2)17(23)22-15/h5-10H,1-2H2,3-4H3,(H3,20,21,22,23,24)/p-1
InChIKeyMRRLNBCXYXFMFO-UHFFFAOYSA-M
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
neoechinulin B (anion) (CHEBI:193005) is a 2,5-diketopiperazines (CHEBI:65061)
Synonym  Source
cyclo-L-2-tert-DMA-Trp-L-Ala Δ10,11 Δ14,15SUBMITTER
UniProt Name  Source
neoechinulin BUniProt
Citations