OMP

OROTIDINE-5'-MONOPHOSPHATE

Created:	1999-07-08
Last modified:	2012-01-05

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18 entries where OMP is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	37
Chiral Atom Count	4
Bond Count	38
Aromatic Bond Count	0

2D diagram of OMP

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Chemical Component Summary
Name	OROTIDINE-5'-MONOPHOSPHATE
Systematic Name (OpenEye OEToolkits)	3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl]-2,6-dioxo-pyrimidine-4-carboxylic acid
Formula	C₁₀ H₁₃ N₂ O₁₁ P
Molecular Weight	368.191
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(O)C=1N(C(=O)NC(=O)C=1)C2OC(C(O)C2O)COP(=O)(O)O
SMILES	CACTVS	3.385	O[CH]1[CH](O)[CH](O[CH]1CO[P](O)(O)=O)N2C(=O)NC(=O)C=C2C(O)=O
SMILES	OpenEye OEToolkits	1.7.5	C1=C(N(C(=O)NC1=O)C2C(C(C(O2)COP(=O)(O)O)O)O)C(=O)O
Canonical SMILES	CACTVS	3.385	O[C@H]1[C@@H](O)[C@@H](O[C@@H]1CO[P](O)(O)=O)N2C(=O)NC(=O)C=C2C(O)=O
Canonical SMILES	OpenEye OEToolkits	1.7.5	C1=C(N(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O)C(=O)O
InChI	InChI	1.03	InChI=1S/C10H13N2O11P/c13-5-1-3(9(16)17)12(10(18)11-5)8-7(15)6(14)4(23-8)2-22-24(19,20)21/h1,4,6-8,14-15H,2H2,(H,16,17)(H,11,13,18)(H2,19,20,21)/t4-,6-,7-,8-/m1/s1
InChIKey	InChI	1.03	KYOBSHFOBAOFBF-XVFCMESISA-N

Drug Info: DrugBank

DrugBank ID	DB02957
Name	Orotidylic acid
Groups	experimental
Synonyms	orotidine 5'-(dihydrogen phosphate) Orotidine 5'-monophosphate 5-(Dihydrogen phosphate)orotidine Orotidine 5'-phosphate Orotidylic acid 6-carboxy-5'-uridylic acid
Categories	Nucleic Acids, Nucleotides, and Nucleosides Nucleotides Pyrimidine Nucleotides Pyrimidines Ribonucleotides Uracil Nucleotides
CAS number	2149-82-8

Related Resource References

Resource Name	Reference
PubChem	160617
ChEMBL	CHEMBL1207358
ChEBI	CHEBI:15842

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