FComEx: Orotic acid (PC000122)

Record Information

Version

1.0

Creation date

2015-10-09 22:28:38 UTC

Update date

2017-01-19 02:36:13 UTC

FoodComEx ID

PC000122

FoodDB Record

FDB012327

Chemical Information

Name

Orotic acid

Description

Occurs in milk and other biol. systems. Salts used as dietary and mineral supplements Orotic acid is a heterocyclic compound and an acid; it is also known as pyrimidinecarboxylic acid. It was once believed to be part of the vitamin B complex and was called vitamin B13, but it is now known that it is not a vitamin but is instead manufactured in the body by intestinal flora. Orotic acid is found in milk and milk products.

CAS Number

65-86-1

Structure

MOL SDF PDB SMILES InChI

Synonyms

Synonym	Source
1,2,3,4-Tetrahydro-2,6-dioxopyrimidine-4-carboxylic acid	biospider
1,2,3,6-Tetrahydro-2,6-dioxo-4-pyrimidecarboxylic acid	HMDB
1,2,3,6-Tetrahydro-2,6-dioxo-4-pyrimidinecarboxylic acid	HMDB
1,2,3,6-Tetrahydro-2,6-dioxo-4-pyrimidinecarboxylic acid, 9CI	db_source
1,2,3,6-Tetrahydro-2,6-dioxopyrimidin-4-carbonsaeure	HMDB
2,6-Dihydroxy-4-pyrimidinecarboxylic acid	HMDB
2,6-Dihydroxypyrimidine-4-carboxylic acid	biospider
2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid	biospider
2,6-Dioxo-1,2,3,6-tetrahydro-pyrimidine-4-carboxylic acid	biospider
2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid	biospider
2,6-dioxo-3H-pyrimidine-4-carboxylic acid	biospider
4-Pyrimidinecarboxylic acid, 1,2,3,6-tetrahydro-2,6-dioxo-	biospider
4-Pyrimidinecarboxylic acid, 2,6-dihydroxy-	biospider
6-Carboxy-2,4-dihydroxypyrimidine	biospider
6-Carboxyuracil	biospider
6-Uracilcarboxylic acid	biospider
Acide orotique	HMDB
Acido orotico	HMDB
Acidum oroticum	HMDB
Animal galactose factor	biospider
Lactinium	HMDB
Molkensaeure	HMDB
ORO	HMDB
Orodin	biospider
Oropur	biospider
Orotate	biospider
Orotic acid, BAN, INN	db_source
Orotonin	biospider
Orotonsan	biospider
Orotsaeure	ChEBI
Orotsaure	HMDB
Oroturic	biospider
Orotyl	biospider
Pyrimidinecarboxylic acid	manual
Uracil-6-carbosaeure	HMDB
Uracil-6-carboxylate	biospider
Uracil-6-carboxylic acid	db_source
Vitamin B13	db_source
Whey factor	db_source

Chemical Formula

C10H8N4O8

IUPAC name

bis(2,6-dihydroxypyrimidine-4-carboxylic acid)

InChI Identifier

InChI=1S/2C5H4N2O4/c2*8-3-1-2(4(9)10)6-5(11)7-3/h2*1H,(H,9,10)(H2,6,7,8,11)

InChI Key

HTXAWQWIIRILGC-UHFFFAOYSA-N

Isomeric SMILES

OC(=O)C1=CC(=O)NC(=O)N1.OC(=O)C1=NC(O)=NC(O)=C1

Average Molecular Weight

312.1925

Monoisotopic Molecular Weight

312.034213252

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as pyrimidinecarboxylic acids. These are pyrimidines with a structure containing a carboxyl group attached to the pyrimidine ring.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Diazines

Sub Class

Pyrimidines and pyrimidine derivatives

Direct Parent

Pyrimidinecarboxylic acids

Alternative Parents