Orotate
Orotate synonyms
Orotonsan; AI3-25478; Uracil-6-carbosaeure; OROTIC ACID; 1,2,3,6-Tetrahydro-2,6-dioxopyrimidin-4-carbonsaeure; Oropur; Orotyl; NSC 9791; Orotic acid [INN:JAN]; Orotic acid (VAN) (8CI); Acido orotico [Spanish]
Graphical representations:
View large 3D structure
Molecular Formula: C5H4N2O4
Natural Isotopic Abundance Mass: 156.0962600000
Mono-Isotopic Molecular Masses:
- C12N14: 156.017106627
- C13N14: 161.033880816
- C12N15: 158.011176414
- C13N15: 161.033880816
InChI string: InChI=1/C5H4N2O4/c8-3-1-2(4(9)10)6-5(11)7-3/h1H,(H,9,10)(H2,6,7,8,11)/f/h6-7,9H
IUPAC: 2,6-dioxo-3H-pyrimidine-4-carboxylic acid
PubChem Compound (CID): 967KEGG Compound ID: C00295
ChemIDplus: 000065861
CAS Registry number: 65-86-1 6784-70-9
EINECS: 200-619-8
CCRIS: 3929
HSDB: 6377
Reference data were obtained primarily from the PubChem database.
Three dimensional molecular rendering uses Jmol.
InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)