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5-Aminoorotic acid
SpectraBase Compound ID 2mkEKyocYU2
InChI InChI=1S/C5H5N3O4/c6-1-2(4(10)11)7-5(12)8-3(1)9/h6H2,(H,10,11)(H2,7,8,9,12)
InChIKey HWCXJKLFOSBVLH-UHFFFAOYSA-N
Mol Weight 171.11 g/mol
Molecular Formula C5H5N3O4
Exact Mass 171.028006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8v1IjsLc9Mt
Name 4-Pyrimidinecarboxylic acid, 5-amino-2,6-dihydroxy-
Alternate Name(s) 4-Pyrimidinecarboxylic acid, 5-amino-1,2,3,6-tetrahydro-2,6-dioxo- 5-Amino-2,6-dihydroxypyrimidine-4-carboxylic acid 5-Amino-2,4-diketo-1H-pyrimidine-6-carboxylic acid 5-Amino-2,4-dioxo-1H-pyrimidine-6-carboxylic acid 5-Amino-2,6-dihydroxy-4-pyrimidinecarboxylic acid 5-Amino-2,6-dioxo-1,2,3,4-tetrahydropyrimidine-4-carboxylic acid 5-Amino-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid 5-Amino-2,6-dioxo-1,2,3,6-tetrahydro-pyrimidine-4-carboxylic acid 5-Amino-6-carboxy-2,4-dihydroxypyrimidine 5-Azanyl-2,4-bis(oxidanylidene)-1H-pyrimidine-6-carboxylic acid 5-Aminoorotic acid Orothic acid, 5-amino- Orotic acid, 5-amino- EINECS 230-514-2 NSC 43249
CAS Registry Number 7164-43-4
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Formula C5H5N3O4
InChI InChI=1S/C5H5N3O4/c6-1-2(4(10)11)7-5(12)8-3(1)9/h6H2,(H,10,11)(H2,7,8,9,12)
InChIKey HWCXJKLFOSBVLH-UHFFFAOYSA-N
Molecular Weight 171.112 g/mol
SMILES Oc1nc(nc(c1N)C(=O)O)O
SPLASH splash10-0fk9-9400000000-702b5944a40494c873ca
Source of Spectrum IY-2-4854-8
Wiley ID 1656771