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Creatine-[methyl-d3] monohydrate

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General Information
Catalog: BLP-011084
CAS: 284664-86-4
Molecular Formula: C4H8D3N3O3
Molecular Weight: 152.17

Chemical Structure

Description	Creatine-[methyl-d3] monohydrate, is the labelled analogue of Creatinine. Creatine is found in vertebrates where it facilitates recycling of adenosine triphosphate (ATP). Creatine can be used as a buffer.
Synonyms	4-Amidinosarcosine-methyl-d3 monohydrate; Creatine-(methyl-d3) monohydrate
IUPAC Name	2-[carbamimidoyl(trideuteriomethyl)amino]acetic acid;hydrate
Related CAS	6020-87-7 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])N(CC(=O)O)C(=N)N.O
Canonical SMILES	[H]O[H].[2H]C([2H])([2H])N(CC(O)=O)C(N)=N
InChI	InChI=1S/C4H9N3O2.H2O/c1-7(4(5)6)2-3(8)9;/h2H2,1H3,(H3,5,6)(H,8,9);1H2/i1D3;
InChI Key	MEJYXFHCRXAUIL-NIIDSAIPSA-N
Melting Point	292°C (dec.) (lit.)
Purity	99% by CP; 98% atom D
Appearance	White solid
Storage	Store at -20°C