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(2S)-2-[[4-[[(2,4-Diaminopteridin-6-yl)amino]methyl]benzoyl]amino]pentanedioic acid

CAS
53661-94-2
Catalog Number
ACM53661942
Category
Other Products
Molecular Weight
440.413 g/mol
Molecular Formula
C19H20N8O5

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Specification

Synonyms
Isoaminopterin, Iso-Aminopterin, CID427395, NSC211519, L-Glutamic acid, N-[4-[[(2,4-diamino-6-pteridinyl)amino]methyl]benzoyl]-, 53661-94-2
IUPAC Name
2-[[4-[[(2,4-diaminopteridin-6-yl)amino]methyl]benzoyl]amino]pentanedioic acid
Canonical SMILES
C1=CC(=CC=C1CNC2=CN=C3C(=N2)C(=NC(=N3)N)N)C(=O)NC(CCC(=O)O)C(=O)O
InChI Key
IZMQQJRPFCPPQS-UHFFFAOYSA-N
Density
1.588g/cm³
Exact Mass
440.15600
H-Bond Acceptor
12
H-Bond Donor
6
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