N-(4-{[(2,4-DIAMINOPTERIDIN-1-IUM-6-YL)METHYL](METHYL)AMINO}BENZOYL)-L-GLUTAMIC ACID (CHEBI:44056)

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CHEBI:44056 - N-(4-{[(2,4-DIAMINOPTERIDIN-1-IUM-6-YL)METHYL](METHYL)AMINO}BENZOYL)-L-GLUTAMIC ACID

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ChEBI ID	CHEBI:44056
ChEBI Name	N-(4-{[(2,4-DIAMINOPTERIDIN-1-IUM-6-YL)METHYL](METHYL)AMINO}BENZOYL)-L-GLUTAMIC ACID
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Last Modified	16 May 2008
Downloads	Molfile

Formula	C20H23N8O5
Net Charge	+1
Average Mass	455.455
Monoisotopic Mass	455.17859
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(C([H])([H])[H])C([H])([H])c2nc3c(N([H])[H])nc(N([H])[H])[n+]([H])c3nc2[H])c([H])c1[H]
InChI	InChI=1S/C20H22N8O5/c1-28(9-11-8-23-17-15(24-11)16(21)26-20(22)27-17)12-4-2-10(3-5-12)18(31)25-13(19(32)33)6-7-14(29)30/h2-5,8,13H,6-7,9H2,1H3,(H,25,31)(H,29,30)(H,32,33)(H4,21,22,23,26,27)/p+1/t13-/m0/s1
InChIKey	FBOZXECLQNJBKD-ZDUSSCGKSA-O

ChEBI Ontology

Outgoing Relation(s)
	N-(4-{[(2,4-DIAMINOPTERIDIN-1-IUM-6-YL)METHYL](METHYL)AMINO}BENZOYL)-L-GLUTAMIC ACID (CHEBI:44056) is a unclassifieds (CHEBI:27189)

Synonyms	Source
N-(4-{[(2,4-DIAMINOPTERIDIN-1-IUM-6-YL)METHYL](METHYL)AMINO}BENZOYL)-L-GLUTAMIC ACID	PDBeChem
N-[(4-{[(2,4-diaminopteridin-1-ium-6-yl)methyl](methyl)amino}phenyl)carbonyl]-L-glutamic acid	PDBeChem

Manual Xrefs	Databases
MT1	PDBeChem