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4-Hydroxy-3-methoxymandelic acid-[d3]

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General Information
Catalog: BLP-007396
CAS: 74495-70-8
Molecular Formula: C9H7D3O5
Molecular Weight: 201.19

Chemical Structure

Description	4-Hydroxy-3-Methoxymandelic Acid-[ring-d3] is the labelled analogue of VMA, which is an impurity of Epinephrine. Epinephrine is a natural neurotransmitter that is released from the adrenal medulla and activates adrenoceptors.
Synonyms	4-Hydroxy-3-methoxymandelic Acid D3; α,4-Dihydroxy-3-(methoxy-d3)benzeneacetic Acid; (+/-)-Vanilmandelic Acid-d3; [4-Hydroxy-3-(methoxy-d3)phenyl]glycolic Acid; 3-(Methoxy-d3)-4-hydroxyphenylhydroxyacetic Acid; HMMA-d3; VMA-d3; Vanilinmandelic Acid-d3; dl-Vanillomandelic Acid-d3
IUPAC Name	2-hydroxy-2-[4-hydroxy-3-(trideuteriomethoxy)phenyl]acetic acid
Related CAS	55-10-7 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])OC1=C(C=CC(=C1)C(C(=O)O)O)O
Canonical SMILES	COC1=C(C=CC(=C1)C(C(=O)O)O)O
InChI	InChI=1S/C9H10O5/c1-14-7-4-5(2-3-6(7)10)8(11)9(12)13/h2-4,8,10-11H,1H3,(H,12,13)/i1D3
InChI Key	CGQCWMIAEPEHNQ-FIBGUPNXSA-N
Melting Point	113-115°C
Purity	98% by CP; 98% atom D
Solubility	Soluble in Ethyl Acetate (Slightly, Heated), Methanol (Slightly)
Appearance	White to Light Orange Solid
Storage	Store at 2-8°C