Cas no 70230-74-9 (INOSINE, 3-METHYL-)
INOSINE, 3-METHYL- structure
Product Name:INOSINE, 3-METHYL-
CAS No:70230-74-9
MF:C11H14N4O5
MW:282.252662181854
CID:3448269
PubChem ID:126961054
Update Time:2025-04-21
INOSINE, 3-METHYL- Chemical and Physical Properties
Names and Identifiers
-
- INOSINE, 3-METHYL-
- 3-methylinosine
- 70230-74-9
-
- Inchi： 1S/C11H14N4O5/c1-14-3-13-9(19)6-10(14)15(4-12-6)11-8(18)7(17)5(2-16)20-11/h3-5,7-8,11,16-18H,2H2,1H3/t5-,7-,8-,11-/m1/s1
- InChI Key： JFUBQXBPIDZBSH-IOSLPCCCSA-N
- SMILES： O1[C@H](CO)[C@H]([C@H]([C@@H]1N1C=NC2C(N=CN(C)C1=2)=O)O)O
Computed Properties
- Exact Mass: 282.09641956g/mol
- Monoisotopic Mass: 282.09641956g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 433
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.9
- Topological Polar Surface Area: 120?2
INOSINE, 3-METHYL- Related Literature
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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