Cas no 55968-37-1 (3'-deoxyguanosine 5'-(tetrahydrogen triphosphate))
55968-37-1 structure
Product Name:3'-deoxyguanosine 5'-(tetrahydrogen triphosphate)
CAS No:55968-37-1
MF:C10H16N5O13P3
MW:507.181024551392
CID:1596659
PubChem ID:135434165
Update Time:2025-04-21
3'-deoxyguanosine 5'-(tetrahydrogen triphosphate) Chemical and Physical Properties
Names and Identifiers
-
- 3'-deoxyguanosine 5'-(tetrahydrogen triphosphate)
- [[(2S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
- Q27460726
- Guanosine 5'-(tetrahydrogen triphosphate), 3'-deoxy-
- CHEMBL480707
- GH3
- 55968-37-1
- 3'-DEOXY-GUANOSINE-5'-TRIPHOSPHATE
- SCHEMBL1913809
- 3'-Deoxyguanosine-5'-triphosphate
- 3'-dGTP
- 3'-Deoxyguanine-5'-triphosphate
- [[(2S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-4-hydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate
- DTXSID20204548
-
- Inchi: 1S/C10H16N5O13P3/c11-10-13-7-6(8(17)14-10)12-3-15(7)9-5(16)1-4(26-9)2-25-30(21,22)28-31(23,24)27-29(18,19)20/h3-5,9,16H,1-2H2,(H,21,22)(H,23,24)(H2,18,19,20)(H3,11,13,14,17)/t4-,5+,9+/m0/s1
- InChI Key: QGYIFQKZZSSUCR-OBXARNEKSA-N
- SMILES: P(=O)(O)(OP(=O)(O)OP(=O)(O)O)OC[C@@H]1C[C@H]([C@H](N2C=NC3C(NC(N)=NC2=3)=O)O1)O
Computed Properties
- Exact Mass: 506.99588
- Monoisotopic Mass: 506.99574658g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 7
- Hydrogen Bond Acceptor Count: 15
- Heavy Atom Count: 31
- Rotatable Bond Count: 8
- Complexity: 895
- 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
- XLogP3: -4.8
- Topological Polar Surface Area: 275?2
Experimental Properties
- PSA: 274.58
3'-deoxyguanosine 5'-(tetrahydrogen triphosphate) Related Literature
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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