L-Glutamic acid,N-[4-[acetyl[(2-amino-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-,calcium salt(1:1)(9ci)

CAS

80402-40-0

Catalog Number

ACM80402400

Category

Other Products

Molecular Weight

487.4659

Molecular Formula

C₂₁H₂₅N₇O₇.Ca

MSDS COA Spec Sheet

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Specification

Synonyms

NSC330762, NSC-330762, 80402-40-0

IUPAC Name

calcium;2-[[4-[acetyl-[(2-amino-4-oxo-5,6,7,8-tetrahydro-1H-pteridin-6-yl)methyl]amino]benzoyl]amino]pentanedioic acid

Canonical SMILES

CC(=O)N(CC1CNC2=C(N1)C(=O)N=C(N2)N)C3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O.[Ca+2]

InChI Key

UUKWOLRODZTEEP-UHFFFAOYSA-N

Density

1.64g/cm³

Exact Mass

527.14400

H-Bond Acceptor

H-Bond Donor

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