Cas no 84296-31-1 (Adenosine5'-(tetrahydrogen triphosphate), 2'-deoxy-1-methyl- (9CI))
84296-31-1 structure
Product Name:Adenosine5'-(tetrahydrogen triphosphate), 2'-deoxy-1-methyl- (9CI)
CAS No:84296-31-1
MF:C11H18N5O12P3
MW:505.208204746246
CID:732566
PubChem ID:158481
Update Time:2025-04-19
Adenosine5'-(tetrahydrogen triphosphate), 2'-deoxy-1-methyl- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Adenosine5'-(tetrahydrogen triphosphate), 2'-deoxy-1-methyl- (9CI)
- [hydroxy-[[(2R,3S)-3-hydroxy-5-(6-imino-1-methylpurin-9-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate
- 9-[2-Deoxy-5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)pentofuranosyl]-1-methyl-1,9-dihydro-6H-purin-6-imine
- DTXSID501004597
- 84296-31-1
- Adenosine 5'-(tetrahydrogen triphosphate), N,6-didehydro-2'-deoxy-1,6-dihydro-1-methyl-
-
- Inchi： 1S/C11H18N5O12P3/c1-15-4-14-11-9(10(15)12)13-5-16(11)8-2-6(17)7(26-8)3-25-30(21,22)28-31(23,24)27-29(18,19)20/h4-8,12,17H,2-3H2,1H3,(H,21,22)(H,23,24)(H2,18,19,20)/t6-,7+,8?/m0/s1
- InChI Key： IHCUIOJGPHXEOP-KJFJCRTCSA-N
- SMILES： P(=O)(O)(OP(=O)(O)OP(=O)(O)O)OC[C@@H]1[C@H](CC(N2C=NC3C(=N)N(C)C=NC2=3)O1)O
Computed Properties
- Exact Mass: 505.016
- Monoisotopic Mass: 505.016
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 6
- Hydrogen Bond Acceptor Count: 15
- Heavy Atom Count: 31
- Rotatable Bond Count: 8
- Complexity: 882
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -4.7
- Topological Polar Surface Area: 247?2
Experimental Properties
- Density: 2.33
- Boiling Point: 896.6°Cat760mmHg
- Flash Point: 496.1°C
- Refractive Index: 1.82
- PSA: 278.20000
- LogP: -0.65930
Adenosine5'-(tetrahydrogen triphosphate), 2'-deoxy-1-methyl- (9CI) Related Literature
-
Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
-
Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
-
Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
-
Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
84296-31-1 (Adenosine5'-(tetrahydrogen triphosphate), 2'-deoxy-1-methyl- (9CI)) Related Products
- 119340-53-3(Cyclic ADP-ribose)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
- 1449132-38-0(3-Fluoro-5-(2-fluoro-5-methylbenzylcarbamoyl)benzeneboronic acid)
Recommended suppliers
Changzhou Guanjia Chemical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
TAIXING JOXIN BIO-TEC CO.,LTD.
Gold Member
Audited Supplier
CN Supplier
Bulk
Beyond Pharmaceutical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Reagent
Wuhan Comings Biotechnology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Zouping Mingyuan Import and Export Trading Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Reagent
