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N-Acetyl Folic Acid-[d4]

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General Information
Catalog: BLP-011983
CAS: 461426-36-8
Molecular Formula: C21H17D4N7O7
Molecular Weight: 487.46

Chemical Structure

Description	N-Acetyl Folic Acid-[d4] is the labelled analogue of N-Acetyl Folic Acid, which is an intermediate of folic acid .
Synonyms	N-Acetyl Folic Acid D4
IUPAC Name	(2S)-2-[[4-[(2-acetamido-4-oxo-3H-pteridin-6-yl)methylamino]-2,3,5,6-tetradeuteriobenzoyl]amino]pentanedioic acid
Related CAS	196080-95-2 (unlabelled)
Isomeric SMILES	[2H]C1=C(C(=C(C(=C1C(=O)N[C@@H](CCC(=O)O)C(=O)O)[2H])[2H])NCC2=CN=C3C(=N2)C(=O)NC(=N3)NC(=O)C)[2H]
Canonical SMILES	CC(=O)NC1=NC2=NC=C(N=C2C(=O)N1)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O
InChI	InChI=1S/C21H21N7O7/c1-10(29)24-21-27-17-16(19(33)28-21)25-13(9-23-17)8-22-12-4-2-11(3-5-12)18(32)26-14(20(34)35)6-7-15(30)31/h2-5,9,14,22H,6-8H2,1H3,(H,26,32)(H,30,31)(H,34,35)(H2,23,24,27,28,29,33)/t14-/m0/s1/i2D,3D,4D,5D
InChI Key	MMBBJYJZIOMODD-WMVUXAOGSA-N
Purity	97% atom D
Solubility	Soluble in Ethyl Acetate, Methanol
Appearance	Yellow Solid
Application	Intermediate in the production of labelled Folic Acid
Storage	Store at -20°C