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CHEBI:6947 - Miraxanthin-III

ChEBI IDCHEBI:6947
ChEBI NameMiraxanthin-III
Stars
Last Modified26 March 2015
DownloadsMolfile
FormulaC17H18N2O5
Net Charge0
Average Mass330.340
Monoisotopic Mass330.12157
SMILESO=C(O)C1=C/C(=C/C=N\CCc2ccc(O)cc2)CC(C(=O)O)N1
InChIInChI=1S/C17H18N2O5/c20-13-3-1-11(2-4-13)5-7-18-8-6-12-9-14(16(21)22)19-15(10-12)17(23)24/h1-4,6,8-9,15,19-20H,5,7,10H2,(H,21,22)(H,23,24)/b12-6-,18-8-
InChIKeyLWXJBFFPVPUUSL-JEUDWDASSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Miraxanthin-III (CHEBI:6947) is a non-proteinogenic α-amino acid (CHEBI:83925)
Synonym  Source
Miraxanthin-IIIKEGG COMPOUND
Manual XrefsDatabases
C08556KEGG COMPOUND
C00001597KNApSAcK
Registry NumbersSources
CAS:5589-85-5KEGG COMPOUND