Cas no 7697-49-6 (9H-Purin-6-amine,9-(2-deoxy-b-D-erythro-pentopyranosyl)- (9CI))
7697-49-6 structure
Product Name:9H-Purin-6-amine,9-(2-deoxy-b-D-erythro-pentopyranosyl)- (9CI)
CAS No:7697-49-6
MF:C10H13N5O3
MW:251.241921186447
CID:574439
PubChem ID:269843
Update Time:2025-04-19
9H-Purin-6-amine,9-(2-deoxy-b-D-erythro-pentopyranosyl)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 9H-Purin-6-amine,9-(2-deoxy-b-D-erythro-pentopyranosyl)- (9CI)
- 6-methylpurine-2'-deoxyriboside
- 9-(2-deoxypentopyranosyl)-9h-purin-6-amine
- AC1L6NCF
- AC1Q4X8I
- AR-1H4962
- CTK0I3599
- NSC111359
- NSC113941
- 6-(6-Amino-9H-purin-9-yl)tetrahydro-2H-pyran-3,4-diol
- 7697-49-6
- DTXSID30998244
- NSC-113941
- 6-(6-aminopurin-9-yl)oxane-3,4-diol
- 6-(6-amino-9H-purin-9-yl)oxane-3,4-diol
- NSC-111359
- DTXSID10296775
- 17434-50-3
-
- Inchi： 1S/C10H13N5O3/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(16)6(17)2-18-7/h3-7,16-17H,1-2H2,(H2,11,12,13)
- InChI Key： NCOXWUCHLQRZJI-UHFFFAOYSA-N
- SMILES： O1CC(C(CC1N1C=NC2C(N)=NC=NC1=2)O)O
Computed Properties
- Exact Mass: 251.10200
- Monoisotopic Mass: 251.10183929g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 18
- Rotatable Bond Count: 1
- Complexity: 307
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.1
- Topological Polar Surface Area: 119?2
Experimental Properties
- PSA: 119.31000
- LogP: -0.36960
9H-Purin-6-amine,9-(2-deoxy-b-D-erythro-pentopyranosyl)- (9CI) Related Literature
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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