Nucleosides and Analogues
Idoxuridine, TRC
CAS: 54-42-2 Molecular Formula: C9 H11 I N2 O5 Molecular Weight (g/mol): 354.1 Synonym: Idoxuridine,Uridine, 2'-deoxy-5-iodo- (6CI, 7CI, 8CI, 9CI, ACI),2'-Deoxy-5-iodouridine (ACI),(+)-5-Iodo-2'-deoxyuridine,1-(2-Deoxy-β-D-ribofuranosyl)-5-iodouracil,5-Iodo-2'-deoxyuridine,5-Iodo-2'-desoxyuridine,5-Iododeoxyuridine,5-Iodouracil deoxyriboside,5IUDR,Allergan 211,Dendrid,Emanil,Herpe-Gel,Herpesil,Herpidu,Herplex,Idexur,Idoxene,Idoxuridin,IDU,Idu Oculos,Iducher,Idulea,IDUR,Iduridin,Iododeoxyuridine,Iododeozyuridine,IUDR,Joddeoxiuridin,Kerecid,MeSH ID: D007065,NSC 39661,Ophthalmadine,SKF 14287,Stoxil,Stoxip,Synmiol,Virudox IUPAC Name: 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-iodopyrimidine-2,4-dione SMILES: OC[C@H]1O[C@H](C[C@@H]1O)N2C=C(I)C(=O)NC2=O
Fialuridine, TRC
CAS: 69123-98-4 Molecular Formula: C9 H10 F I N2 O5 Molecular Weight (g/mol): 372.09 Synonym: 2,4(1H,3H)-Pyrimidinedione, 1-(2-deoxy-2-fluoro-β-D-arabinofuranosyl)-5-iodo-,1-(2-Deoxy-2-fluoro-β-D-arabinofuranosyl)-5-iodo-2,4(1H,3H)-pyrimidinedione,1-(2-Deoxy-2-fluoro-β-D-arabinofuranosyl)-5-iodouracil,1-(2'-Deoxy-2'-fluoro-β-D-arabinofuranosyl)-5-iodouracil,5-Iodo-2'-fluoroarauracil,FIAU,Fialuridine,Fluoroiodoarauracil,NSC 678514 IUPAC Name: 1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-iodopyrimidine-2,4-dione SMILES: OC[C@H]1O[C@H]([C@@H](F)[C@@H]1O)N2C=C(I)C(=O)NC2=O
Levovirin, TRC
CAS: 206269-27-4 Molecular Formula: C8 H12 N4 O5 Molecular Weight (g/mol): 244.2 Synonym: 1-β-L-Ribofuranosyl-1H-1,2,4-triazole-3-carboxamide,ICN 17261,L-Ribavirin IUPAC Name: 1-[(2S,3S,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,4-triazole-3-carboxamide SMILES: NC(=O)c1ncn(n1)[C@H]2O[C@@H](CO)[C@H](O)[C@@H]2O
Gemcitabine, TRC
CAS: 95058-81-4 Molecular Formula: C9H11F2N3O4 Molecular Weight (g/mol): 263.2 Synonym: 2'-Deoxy-2',2'-difluorocytidine,2',2'-Difluoro-2'-deoxycytidine,2',2'-Difluorodeoxycytidine,DDFC,DFdC,DFdCyd,Folfugem,GemLip,Gemcel,Gamcitabine,LY 188011,NSC 613327,Zefei; IUPAC Name: 4-amino-1-[(2R,4R,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one SMILES: NC1=NC(=O)N(C=C1)[C@@H]2O[C@H](CO)[C@@H](O)C2(F)F
Cladribine, TRC
CAS: 4291-63-8 Molecular Formula: C10 H12 Cl N5 O3 Molecular Weight (g/mol): 285.69 Synonym: Cladribine,2-Chloro-9-(2-deoxy-β-d-erythro-pentofuranosyl)-9H-purin-6-amine,Adenosine, 2-chloro-2'-deoxy-,2-Chloro-2'-deoxyadenosine,(2R,3S,5R)-5-(6-Amino-2-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol,2-CdA,2-Chloro-2'-deoxy-β-adenosine,2-Chloro-6-amino-9-(2-deoxy-β-D-erythro-pentofuranosyl)purine,2-Chlorodeoxyadenosine,Biodribin,Cladarabine,CldAdo,Jk 6251,Leustat,Leustatin,NSC 105014,NSC 105014-F,RWJ 26251 IUPAC Name: (2R,3S,5R)-5-(6-amino-2-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol SMILES: Nc1nc(Cl)nc2c1ncn2[C@H]3C[C@H](O)[C@@H](CO)O3
Emtricitabine, TRC
CAS: 143491-57-0 Molecular Formula: C8 H10 F N3 O3 S Molecular Weight (g/mol): 247.25 Synonym: 2(1H)-Pyrimidinone, 4-amino-5-fluoro-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-,2(1H)-Pyrimidinone, 4-amino-5-fluoro-1-[2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-, (2R-cis)-,1,3-Oxathiolane, 2(1H)-pyrimidinone deriv.,4-Amino-5-fluoro-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-2(1H)-pyrimidinone,(-)-2',3'-Dideoxy-5-fluoro-3'-thiacytidine,(-)-2'-Deoxy-5-fluoro-3'-thiacytidine,(-)-Emtricitabine,(-)-FTC,524W91,BW 1592,BW 524W91,Coviracil,Emtricitabine,Emtriva,(-)-FTC IUPAC Name: 4-amino-5-fluoro-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2-one SMILES: NC1=NC(=O)N(C=C1F)[C@@H]2CS[C@H](CO)O2
Clevudine, TRC
CAS: 163252-36-6 Molecular Formula: C10H13FN2O5 Molecular Weight (g/mol): 260.22 Synonym: 1-(2'-Deoxy-2'-fluoro-beta-L-arabinofuranosyl)-5-methyluracil,L-FMAU,1-(2-Deoxy-2-fluoro-beta-L-arabinofuranosyl)-5-methyl-2,4(1H,3H)-pyrimidinedione IUPAC Name: 1-[(2S,3R,4S,5S)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione SMILES: CC1=CN([C@H]2O[C@@H](CO)[C@H](O)[C@H]2F)C(=O)NC1=O
Lamivudine, TRC
CAS: 134678-17-4 Molecular Formula: C8 H11 N3 O3 S Molecular Weight (g/mol): 229.26 Synonym: Lamivudine,2(1H)-Pyrimidinone, 4-amino-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-,2(1H)-Pyrimidinone, 4-amino-1-[2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-, (2R-cis)-,1,3-Oxathiolane, 2(1H)-pyrimidinone deriv.,(-)-2'-Deoxy-3'-thiacytidine,(-)-BCH 189,2-Hydroxymethyl-5-(cytosin-1-yl)-1,3-oxathiolane,3TC,BCH 189, (-)-,Epivir,Epivir HBV,GR 109714X,Hepitec,Heptodin,Heptovir,L-SddC,Lamivir,Virolam,Zeffix,Zefix,cis(-)-2-Hydroxymethyl-5-(cytosin-1-yl)-1,3-oxathiolane,β-L-2',3'-Dideoxy-3'-thiacytidine,β-L-3'-Thia-2',3'-dideoxycytidine IUPAC Name: 4-amino-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2-one SMILES: NC1=NC(=O)N(C=C1)[C@@H]2CS[C@H](CO)O2
Zalcitabine, TRC
CAS: 7481-89-2 Molecular Formula: C9 H13 N3 O3 Molecular Weight (g/mol): 211.22 Synonym: Cytidine, 2',3'-dideoxy-,2',3'-Dideoxycytidine,D 2C,Dideoxycytidine,Hivid,NSC 606170,Ro 24-2027/000,Zalcitabine,ddC IUPAC Name: 4-amino-1-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one SMILES: NC1=NC(=O)N(C=C1)[C@H]2CC[C@@H](CO)O2
Clofarabine, TRC
CAS: 123318-82-1 Molecular Formula: C10 H11 Cl F N5 O3 Molecular Weight (g/mol): 303.68 Synonym: 2-Chloro-9-(2-deoxy-2-fluoro-β-D-arabinofuranosyl)-9H-purin-6-amine,2-Chloro-9-(2-deoxy-2-fluoro-β-D-arabinofuranosyl)adenine,Clofarabine,Clofarex,Clolar,Evoltra IUPAC Name: (2R,3R,4S,5R)-5-(6-amino-2-chloropurin-9-yl)-4-fluoro-2-(hydroxymethyl)oxolan-3-ol SMILES: Nc1nc(Cl)nc2c1ncn2[C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F
Cordycepin, TRC
CAS: 73-03-0 Molecular Formula: C10 H13 N5 O3 Molecular Weight (g/mol): 251.24 Synonym: Adenosine, 3'-deoxy-,Cordycepin (6CI,7CI),3'-Deoxyadenosine,9-(3-Deoxy-β-D-ribofuranosyl)adenine,9-Cordyceposidoadenine,9H-Purin-6-amine, 9-(3-deoxy-β-D-erythro-pentofuranosyl)-,Cordycepine,NSC 401022,NSC 63984,β-D-erythro-Pentofuranoside, adenine-9 3-deoxy- IUPAC Name: (2R,3R,5S)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolan-3-ol SMILES: Nc1ncnc2c1ncn2[C@@H]3O[C@H](CO)C[C@H]3O
Toyocamycin, TRC
CAS: 606-58-6 Molecular Formula: C12H13N5O4 Molecular Weight (g/mol): 291.26 Synonym: 4-Amino-7-beta-D-ribofuranosyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile,4-Amino-5-cyano-7-(beta-D-ribofuranosyl)pyrrolo[2,3-d]pyrimidine,7-Cyano-7-deazaadenosine,Antibiotic 1037,Antibiotic E 212,MT 1155,NSC 63701NSC 99843,SIPI 763-1,Toyocamycin Nucleoside,Unamycin B,Vengicide IUPAC Name: 4-amino-7-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile SMILES: Nc1ncnc2c1c(cn2[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C#N
Sangivamycin, TRC
CAS: 18417-89-5 Molecular Formula: C12H15N5O5 Molecular Weight (g/mol): 309.28 Synonym: 4-Amino-7-beta-D-ribofuranosyl-7H-pyrrolo[2,3-d]pyrimidine-5-carboxamide,7-Deazaadenosine-7-carboxamide,NSC 65346 IUPAC Name: 3,4,7,8-tetramethyl-1,10-phenanthroline SMILES: Cc1cnc2c(ccc3c(C)c(C)cnc23)c1C
4-Thiothymidine, TRC
CAS: 7236-57-9 Molecular Formula: C10H14N2O4S Molecular Weight (g/mol): 258.29 IUPAC Name: 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-4-sulfanylidenepyrimidin-2-one SMILES: CC1=CN([C@H]2C[C@H](O)[C@@H](CO)O2)C(=O)NC1=S
Thymidine-d3, TRC
CAS: 74848-84-3 Molecular Formula: C10 2H3 H11 N2 O5 Molecular Weight (g/mol): 245.25 Synonym: Thymidine D3 IUPAC Name: 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(trideuteriomethyl)pyrimidine-2,4-dione SMILES: [2H]C([2H])([2H])C1=CN([C@H]2C[C@H](O)[C@@H](CO)O2)C(=O)NC1=O