General Information of the Compound
Compound ID
CP0073017
Compound Name
[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
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Synonyms
2,4(1H,3H)-pyrimidinedione, 1-(5-O-phosphono-beta-D-ribofuranosyl)-
27416-86-0
5'-UMP
5'-URIDYLIC ACID
5'Uridylic acid
58-97-9
AK113761
BRN 0047486
CHEBI:16695
CHEMBL214393
E2OU15WN0N
EINECS 200-408-0
Polyuridylic acids
U 5'-P
UMP
UMP (nucleic acid)
UNII-E2OU15WN0N
Uridine 5'-(dihydrogen phosphate)
Uridine 5'-monophosphate
Uridine 5'-phosphate
Uridine 5'-phosphoric acid
Uridine 5-monophosphate
Uridine monophosphate
Uridine phosphate
Uridine-5'-Monophosphate
Uridylic acid
uridine-5'-monophosphate
uridylate
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Structure
Formula
C9H13N2O9P
Molecular Weight
324.182
Canonical SMILES
O[C@@H]1[C@@H](COP(O)(O)=O)O[C@H]([C@@H]1O)n1ccc(=O)[nH]c1=O
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InChI
InChI=1S/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1
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InChIKey
DJJCXFVJDGTHFX-XVFCMESISA-N
CAS
27416-86-0
81795-93-9
25618-56-8
53624-79-6
81795-92-8
Physicochemical Property
logP
-2.7349
Rotatable Bonds
4
Heavy Atom Count
21
Polar Areas
171.31
Hydrogen Bond Donor Count
5
Hydrogen Bond Acceptor Count
8
Complexity
21

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

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PubChem ID
CID: 6030
SID: 14899484
ChEMBL ID
CHEMBL214393
DrugBank ID
DB03685
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound

Compound
Cell Line
Protein

Bioactivity Value:

<= 0.1 μM
> 0.1 μM and <= 10 μM
> 10 μM
Imprecise Activity
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT04436, UMP-CMP kinase
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000148 Huh-7 Homo sapiens (Human)  1
1
Km = 151000 nM
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( Uridine-5'-Monophosphate )
Drug Name Uridine-5'-Monophosphate