Wikidata

(Q83004496)

English

N-{4-[1-(2,4-Diimino-1,2,3,4-tetrahydropyrido[3,2-d]pyrimidin-6-yl)pentan-2-yl]benzoyl}glutamic acid--water (2/3)

group of stereoisomers with the chemical formula C₄₈H₆₂N₁₂O₁₃

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Statements

mass
1,014.455930044 dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₄₈H₆₂N₁₂O₁₃
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCCC(Cc1ccc2[nH]c(=N)[nH]c(=N)c2n1)c1ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc1.CCCC(Cc1ccc2[nH]c(=N)[nH]c(=N)c2n1)c1ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc1.O.O.O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCCC(Cc1ccc2[nH]c(=N)[nH]c(=N)c2n1)c1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1.CCCC(Cc1ccc2[nH]c(=N)[nH]c(=N)c2n1)c1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1.O.O.O
1 reference
based on heuristic
inferred from InChI

Identifiers

 
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