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CHEBI:42273 - 5-deazafolic acid

ChEBI IDCHEBI:42273
ChEBI Name5-deazafolic acid
Stars
Last Modified3 December 2014
DownloadsMolfile
FormulaC20H20N6O6
Net Charge0
Average Mass440.416
Monoisotopic Mass440.14443
SMILES[H]OC(=O)C([H])([H])C([H])([H])[C@@]([H])(C(=O)O[H])N([H])C(=O)c1c([H])c([H])c(N([H])C([H])([H])c2c([H])nc3c(c2[H])c(=O)nc(N([H])[H])n3[H])c([H])c1[H]
InChIInChI=1S/C20H20N6O6/c21-20-25-16-13(18(30)26-20)7-10(9-23-16)8-22-12-3-1-11(2-4-12)17(29)24-14(19(31)32)5-6-15(27)28/h1-4,7,9,14,22H,5-6,8H2,(H,24,29)(H,27,28)(H,31,32)(H3,21,23,25,26,30)/t14-/m0/s1
InChIKeyNFARHPAOOHOWAL-AWEZNQCLSA-N
ChEBI Ontology
Outgoing Relation(s)
5-deazafolic acid (CHEBI:42273) is a N-acyl-L-glutamic acid (CHEBI:21650)
5-deazafolic acid (CHEBI:42273) is a pyridopyrimidine (CHEBI:38932)
Synonyms  Source
5-DEAZAFOLIC ACIDPDBeChem
N-[(4-{[(2-amino-4-oxo-1,4-dihydropyrido[2,3-d]pyrimidin-6-yl)methyl]amino}phenyl)carbonyl]-L-glutamic acidPDBeChem
Manual XrefsDatabases
DZFPDBeChem