Cas no 108895-42-7 (Thymidine, 3'-O-methyl-(9CI))
Thymidine, 3'-O-methyl-(9CI) structure
Product Name:Thymidine, 3'-O-methyl-(9CI)
CAS No:108895-42-7
MF:C11H16N2O5
MW:256.255143165588
CID:141368
PubChem ID:72250
Update Time:2025-04-19
Thymidine, 3'-O-methyl-(9CI) Chemical and Physical Properties
Names and Identifiers
-
- Thymidine, 3'-O-methyl-(9CI)
- 1-[(2R,4S,5R)-5-(hydroxymethyl)-4-methoxyoxolan-2-yl]-5-methylpyrimidine-2,4-dione
- 2',3'-dideoxy-3'-O-methylthymidine
- 3'-Methoxy-2',3'-dideoxythymidine
- 3'-OMe-ddT
- 3'-O-Methylthymidine
- AC1L2HPJ
- AC1Q69EH
- NSC665482
- OMET
- SureCN523267
- Thymidine, 3'-O-methyl-
- 1-[(2R,4S,5R)-5-(hydroxymethyl)-4-methoxy-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
- 108895-42-7
- CHEMBL3143720
- SCHEMBL523267
- NSC 665482
- DTXSID00148759
-
- Inchi： 1S/C11H16N2O5/c1-6-4-13(11(16)12-10(6)15)9-3-7(17-2)8(5-14)18-9/h4,7-9,14H,3,5H2,1-2H3,(H,12,15,16)/t7-,8+,9+/m0/s1
- InChI Key： ZGBKEOLAPVBJFC-DJLDLDEBSA-N
- SMILES： O1[C@H](CO)[C@H](C[C@@H]1N1C(NC(C(C)=C1)=O)=O)OC
Computed Properties
- Exact Mass: 256.10598
- Monoisotopic Mass: 256.10592162g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 18
- Rotatable Bond Count: 3
- Complexity: 395
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 3
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: 3
- XLogP3: nothing
- Topological Polar Surface Area: 88.1?2
Experimental Properties
- PSA: 88.1
Thymidine, 3'-O-methyl-(9CI) Related Literature
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
-
Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
108895-42-7 (Thymidine, 3'-O-methyl-(9CI)) Related Products
- 1463-10-1(5-Methyluridine)
- 55486-09-4(5-Methyl-2′-O-methyluridine)
- 3416-05-5(3’-Deoxythymidine)
- 3424-98-4(Telbivudine)
- 38313-48-3(3',5'-Anhydrothymidine)
- 26879-47-0(5-Methyl-L-uridine)
- 605-23-2(1-β-D-Arabinofuranosyl-5-methyl-2,4(1H,3H)-pyrimidinedione)
- 951-78-0(2'-Deoxyuridine)
- 5983-09-5(2’,3’-Dideoxyuridine)
- 50-89-5(Thymidine)
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