Cas no 6284-37-3 (2-(2,6-diaminopurin-9-yl)-6-methyloxane-3,4,5-triol)
6284-37-3 structure
Product Name:2-(2,6-diaminopurin-9-yl)-6-methyloxane-3,4,5-triol
CAS No:6284-37-3
MF:C11H16N6O4
MW:296.282541275024
CID:1647545
PubChem ID:222074
Update Time:2025-04-21
2-(2,6-diaminopurin-9-yl)-6-methyloxane-3,4,5-triol Chemical and Physical Properties
Names and Identifiers
-
- 2-(2,6-diaminopurin-9-yl)-6-methyloxane-3,4,5-triol
- (6R)-6-(2,6-diamino-purin-9-yl)-2,6-anhydro-1-deoxy-L-mannitol
- AC1Q4X89
- AC1L5B9A
- 9-(6-deoxyhexopyranosyl)-9h-purine-2,6-diamine
- (6R)-6-(2,6-Diamino-purin-9-yl)-2,6-anhydro-1-desoxy-L-mannit
- AR-1H5079
- NSC7355
- (6R)-6-(2,6-diamino-purin-9-yl)-2,6-anhydro-1-deoxy-L-mannitol; AC1Q4X89; AC1L5B9A; 9-(6-deoxyhexopyranosyl)-9h-purine-2,6-diamine; (6R)-6-(2,6-Diamino-purin-9-yl)-2,6-anhydro-1-desoxy-L-mannit; AR-1H5079; NSC7355;
- NSC-7355
- DTXSID70278436
- 6284-37-3
-
- Inchi： 1S/C11H16N6O4/c1-3-5(18)6(19)7(20)10(21-3)17-2-14-4-8(12)15-11(13)16-9(4)17/h2-3,5-7,10,18-20H,1H3,(H4,12,13,15,16)
- InChI Key： ZSMPROJUPCHKEF-UHFFFAOYSA-N
- SMILES： O1C(C)C(C(C(C1N1C=NC2C(N)=NC(N)=NC1=2)O)O)O
Computed Properties
- Exact Mass: 296.12348
- Monoisotopic Mass: 296.12330301g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 9
- Heavy Atom Count: 21
- Rotatable Bond Count: 1
- Complexity: 390
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 5
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.5
- Topological Polar Surface Area: 166?2
Experimental Properties
- PSA: 165.56
2-(2,6-diaminopurin-9-yl)-6-methyloxane-3,4,5-triol Related Literature
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
-
Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
-
Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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