Cas no 70639-65-5 (1-methyl-2-oxoadenosine)
1-methyl-2-oxoadenosine structure
Product Name:1-methyl-2-oxoadenosine
CAS No:70639-65-5
MF:C11H15N5O5
MW:297.267301797867
CID:1745686
PubChem ID:155395
Update Time:2025-04-21
1-methyl-2-oxoadenosine Chemical and Physical Properties
Names and Identifiers
-
- 1-methyl-2-oxoadenosine
- Adenosine, 1,2-dihydro-1-methyl-2-oxo-
- 1-Methylisoguanosine
- 6-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-methylpurin-2-one
- 70639-65-5
- BDBM82044
- CHEMBL507609
- DTXCID30143414
- PDSP2_000998
- 6-Amino-9-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-1-methyl-1H-purin-2(9H)-one
- 6-amino-9-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl)-1-methylpurin-2-one
- 1-methyl-2-hydroxyadenosine
- DTXSID00220923
- 1-METHYLISOGUANOSINE A1 ADENOSINE RECEPT OR
- 1-Methyl-2-oxoado
- 6-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-methyl-2,9-dihydro-1H-purin-2-one
- PDSP1_001014
-
- Inchi： 1S/C11H15N5O5/c1-15-8(12)5-9(14-11(15)20)16(3-13-5)10-7(19)6(18)4(2-17)21-10/h3-4,6-7,10,17-19H,2,12H2,1H3/t4-,6-,7-,10-/m1/s1
- InChI Key： NGSRMSVXLUMDAX-KQYNXXCUSA-N
- SMILES： O1[C@H](CO)[C@H]([C@H]([C@@H]1N1C=NC2=C(N)N(C)C(N=C12)=O)O)O
Computed Properties
- Exact Mass: 297.10745
- Monoisotopic Mass: 297.10731860g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 21
- Rotatable Bond Count: 2
- Complexity: 573
- 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: -2.8
- Topological Polar Surface Area: 144?2
Experimental Properties
- PSA: 144.21
1-methyl-2-oxoadenosine Related Literature
-
H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
-
Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
-
Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
-
Kui Wu,Zhihua Yang,Shilie Pan Dalton Trans., 2015,44, 19856-19864
70639-65-5 (1-methyl-2-oxoadenosine) Related Products
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