Molecule

2,4-dioxo-1H-pyrimidine-6-carboxylic acid

Chemical Information

Molecular Image

InChI	InChI=1S/C5H4N2O4/c8-3-1-2(4(9)10)6-5(11)7-3/h1H,(H,9,10)(H2,6,7,8,11)
SMILES	C1=C(NC(=O)NC1=O)C(=O)O
InChI Key	PXQPEWDEAKTCGB-UHFFFAOYSA-N
Exact Mass	156.097 g/mol

27 Related Dataset(s) ⌄

OROTATE; LC-ESI-QFT; MS2; CE: 30eV; [M+H]+

OROTATE; LC-ESI-QTOF; MS2; CE: 10; [M-H]-

OROTATE; LC-ESI-QTOF; MS2; CE: 20; [M-H]-

OROTATE; LC-ESI-QTOF; MS2; CE: 40; [M-H]-

Orotic acid; GC-EI-TOF; MS; n TMS; RT:662.494 sec

Orotic acid; LC-ESI-ITFT; MS2; CE: 100; [M-H]-

Orotic acid; LC-ESI-ITFT; MS2; CE: 10; [M-H]-

Orotic acid; LC-ESI-ITFT; MS2; CE: 20; [M-H]-

Orotic acid; LC-ESI-ITFT; MS2; CE: 30; [M-H]-

Orotic acid; LC-ESI-ITFT; MS2; CE: 40; [M-H]-

Orotic acid; LC-ESI-ITFT; MS2; CE: 60; [M-H]-

Orotic acid; LC-ESI-QTOF; MS2; CE: -10, -35, -60V; [M-H]-

Orotic acid; LC-ESI-QTOF; MS2; CE: 10; [M-H]-

Orotic acid; LC-ESI-QTOF; MS2; CE: 10; [M-H]-

Orotic acid; LC-ESI-QTOF; MS2; CE: 10; [M-H]-

Orotic acid; LC-ESI-QTOF; MS2; CE: 15 / 50; [M-H]-

Orotic acid; LC-ESI-QTOF; MS2; CE: 15 / 50; [M-H]-

Orotic acid; LC-ESI-QTOF; MS2; CE: 15 / 50; [M-H]-

Orotic acid; LC-ESI-QTOF; MS2; CE: 30; [M-H]-

Orotic acid; LC-ESI-QTOF; MS2; CE: 30; [M-H]-

Orotic acid; LC-ESI-QTOF; MS2; CE: 30; [M-H]-

Orotic acid; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M+H]+

Orotic acid; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-

Uracil-6-carboxylic acid, Orotyl, 6-Carboxyuracil, Vitamin B13, Orotate, 2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic Acid, 2,6-Dihydroxypyrimidine-4-carboxylic acid, Orotonin, 6-Carboxy-2,4-dihydroxypyrimidine, Orotic acid ,Anhydrous; LC-ESI-QQ; MS2

Uracil-6-carboxylic acid, Orotyl, 6-Carboxyuracil, Vitamin B13, Orotate, 2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic Acid, 2,6-Dihydroxypyrimidine-4-carboxylic acid, Orotonin, 6-Carboxy-2,4-dihydroxypyrimidine, Orotic acid ,Anhydrous; LC-ESI-QQ; MS2

Uracil-6-carboxylic acid, Orotyl, 6-Carboxyuracil, Vitamin B13, Orotate, 2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic Acid, 2,6-dioxo-3H-pyrimidine-4-carboxylic acid, 2,6-Dihydroxypyrimidine-4-carboxylic acid, Orotonin, 6-Carboxy-2,4-dihydroxypyrimidine, Orotic acid ,Anhydrous; LC-ESI-QTOF; MS2

Uracil-6-carboxylic acid, Orotyl, 6-Carboxyuracil, Vitamin B13, Orotate, 2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic Acid, 2,6-dioxo-3H-pyrimidine-4-carboxylic acid, 2,6-Dihydroxypyrimidine-4-carboxylic acid, Orotonin, 6-Carboxy-2,4-dihydroxypyrimidine, Orotic acid ,Anhydrous; LC-ESI-QTOF; MS2

Metadata Information

Field	Value
NFDI4Chem Molecule ID	nfdi4chem-mol26497
Source
Alternate Name

Field	Value
No additional information available for this Dataset.

Data-Source Molecule ID	Data-Source
DB02262	drugbank
CHEBI:16742	chebi
ORO	rcsb_pdb
CHEMBL1235017	chembl
185887	surechembl
20865	surechembl
967	pubchem
61H4T033E5	fdasrs
4690	gtopdb
PD001471	probes_and_drugs
OROTAC	CCDC
12642	brenda
163082	brenda
446	brenda
68893	brenda
ORO	pdbe
HMDB0000226	hmdb
DTXSID0025814	comptox
NCT01620268	clinicaltrials
FDB031072	foodb
Molport-000-145-888	molport
Molport-000-844-772	molport
3402	drugcentral
The data in this table is sourced from UniChem at EBI.