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Deoxyuridine

PubChem CID: 13712

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Compound Synonyms 2'-DEOXYURIDINE, 951-78-0, deoxyuridine, Uracil deoxyriboside, 2-Deoxyuridine, 1-((2R,4S,5R)-4-Hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione, Uridine, 2'-deoxy-, Deoxyribose uracil, 2'-Desoxyuridine, Desoxyuridine, CCRIS 2832, dURD, EINECS 213-455-7, UNII-W78I7AY22C, NSC 23615, Uracil desoxyuridine, BRN 0024433, 2'-Deoxyuridine-1'-d, DEOXYURIDINE [MI], MFCD00006527, 1-(2-Deoxy-beta-D-erythro-pentofuranoxyl)uracil, 1-(2-Deoxy-beta-D-ribofuranosyl)uracil, 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione, 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione, W78I7AY22C, CHEBI:16450, 2,4(1H,3H)-Pyrimidinedione, 1-(2-deoxy-beta-D-ribofuranosyl)-, DTXSID30883621, 2,4(1H,3H)-Pyrimidinedione, 1-(2-deoxy-beta-D-erythro-ribofuranosyl)-, 4-24-00-01200 (Beilstein Handbook Reference), NSC-23615, 1-(2-Deoxy-D-erythro-pentofuranosyl)uracil, 1-(2-Deoxy-delta-erythro-pentofuranosyl)uracil, 1-(2-deoxy-beta-D-ribofuranosyl)-2,4(1H,3H)-Pyrimidinedione, 1-(2-deoxy-beta-D-erythro-pentofuranosyl)-2,4(1H,3H)-Pyrimidinedione, 1-(2-deoxy-beta-delta-ribofuranosyl)-2,4(1H,3H)-Pyrimidinedione, 1-(2-deoxy-beta-delta-erythro-pentofuranosyl)-2,4(1H,3H)-Pyrimidinedione, DUR, 1-(2-deoxy-beta-D-erythro-pentofuranosyl)uracil, 1-((2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione, 2'-Deoxy-D-uridine, Uridinie, 2'-deoxy-, 2yb0, (beta 1-(2-Deoxyribopyranosyl))thymidine, 1-(2-Deoxy-.beta.-D-erythro-pentofuranoxyl)uracil, bmse000320, SCHEMBL28844, MLS001066344, 1-(4-hydroxy-5-(hydroxymethyl)oxolan-2-yl)pyrimidine-2,4-dione, 1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione, 2,4(1H,3H)-Pyrimidinedione, 1-(2-deoxy-.beta.-D-ribofuranosyl)-, CHEMBL353955, 2 inverted exclamation marka-dU, 2,4(1H,3H)-Pyrimidinedione, 1-(2-deoxy-.beta.-D-erythro-pentofuranosyl)-, 2,4(1H,3H)-Pyrimidinedione, 1-(2-deoxy-beta-D-erythro-pentofuranosyl)-, 2'-Deoxyuridine, >=98.5%, DTXCID601023132, HMS2267D16, HY-D0186, s5505, ZINC00155696, AKOS015833069, AKOS015896792, 1-(2-Deoxy-ss-D-ribofuranosyl)uracil, CCG-247504, CS-W019820, DB02256, ND06282, PS-7750, 1-((2R,4S,5R)-4-Hydroxy-5-(hydroxymethyl)tetrahydro-furan-2-yl)pyrimidine-2,4(1H,3H)-dione, 1-[(4S,2R,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,3-dihydropyrimidine-2, 4-dione, NCGC00142492-01, BP-58660, DA-49411, SMR000112296, D0060, NS00014663, C00526, O10766, EN300-7374520, Q419140, 1-(2-DEOXY-.BETA.-D-ERYTHRO-PENTOFURANOSYL)URACIL, E73B1553-A13A-4989-B045-A589A8F2B9DC, 1-((2R,4S,5R)-4-Hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-1-H-pyrimidine-2,4-dione, 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
Topological Polar Surface Area 99.1
Hydrogen Bond Donor Count 3.0
Heavy Atom Count 16.0
Pathway Kegg Map Id map00240
Description 2'-Deoxyuridine is a naturally occurring nucleoside. It is similar in chemical structure to uridine, but without the 2'-hydroxyl group. It is considered to be an antimetabolite that is converted to deoxyuridine triphosphate during DNA synthesis. Laboratory suppression of deoxyuridine is used to diagnose megaloblastic anemia due to vitamin B12 and folate deficiencies. [HMDB]. Deoxyuridine is found in many foods, some of which are garden tomato (variety), hickory nut, banana, and hazelnut.
Isotope Atom Count 0.0
Molecular Complexity 343.0
Database Name cmaup_ingredients;fooddb_chem_all;npass_chem_all;pubchem
Defined Atom Stereocenter Count 3.0
Enzyme Uniprot Id Q546Y9, P00491, P04183, O00142, P19971, Q9NWZ5
Uniprot Id P19971, P04183, D3ZGQ2, P27158, P04184, P43346, P07650, P09768, A0A0S4TER9
Iupac Name 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
Prediction Hob 1.0
Class Pyrimidine nucleosides
Xlogp -1.6
Superclass Nucleosides, nucleotides, and analogues
Subclass Pyrimidine 2'-deoxyribonucleosides
Molecular Formula C9H12N2O5
Prediction Swissadme 1.0
Inchi Key MXHRCPNRJAMMIM-SHYZEUOFSA-N
Fcsp3 0.5555555555555556
Logs -0.339
Rotatable Bond Count 2.0
State Solid
Logd -1.245
Synonyms 1-(2-deoxy-beta-D-erythro-pentofuranosyl)-2,4(1H,3H)-Pyrimidinedione, 1-(2-deoxy-beta-D-ribofuranosyl)-2,4(1H,3H)-Pyrimidinedione, 1-(2-deoxy-beta-delta-erythro-pentofuranosyl)-2,4(1H,3H)-Pyrimidinedione, 1-(2-deoxy-beta-delta-ribofuranosyl)-2,4(1H,3H)-Pyrimidinedione, 1-(2-Deoxy-D-erythro-pentofuranosyl)uracil, 1-(2-Deoxy-delta-erythro-pentofuranosyl)uracil, 2-Deoxyuridine, 2'-Deoxyuridine, 2'-Desoxyuridine, Deoxyribose uracil, Desoxyuridine, Uracil deoxyriboside, Uracil desoxyuridine
Substituent Name Pyrimidine 2'-deoxyribonucleoside, Hydroxypyrimidine, Pyrimidone, Pyrimidine, Hydropyrimidine, Saccharide, Heteroaromatic compound, Oxolane, Secondary alcohol, Oxacycle, Azacycle, Organoheterocyclic compound, Ether, Hydrocarbon derivative, Primary alcohol, Organooxygen compound, Organonitrogen compound, Alcohol, Aromatic heteromonocyclic compound
Compound Name Deoxyuridine
Kingdom Organic compounds
Prediction Hob Swissadme 1.0
Exact Mass 228.075
Formal Charge 0.0
Monoisotopic Mass 228.075
Hydrogen Bond Acceptor Count 5.0
Molecular Weight 228.2
Covalent Unit Count 1.0
Total Atom Stereocenter Count 3.0
Total Bond Stereocenter Count 0.0
Esol -1.5326647999999996
Inchi InChI=1S/C9H12N2O5/c12-4-6-5(13)3-8(16-6)11-2-1-7(14)10-9(11)15/h1-2,5-6,8,12-13H,3-4H2,(H,10,14,15)/t5-,6+,8+/m0/s1
Smiles C1[C@@H]([C@H](O[C@H]1N2C=CC(=O)NC2=O)CO)O
Nring 2.0
Defined Bond Stereocenter Count 0.0

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