Molecule Info: 2'-Deoxyadenosine 5'-triphosphate
Smiles:
C1C(C(OC1N2C=NC3=C(N=CN=C32)N)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O
InChIKey:
SUYVUBYJARFZHO-RRKCRQDMSA-N
InChI:
InChI=1S/C10H16N5O12P3/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(16)6(25-7)2-24-29(20,21)27-30(22,23)26-28(17,18)19/h3-7,16H,1-2H2,(H,20,21)(H,22,23)(H2,11,12,13)(H2,17,18,19)/t5-,6+,7+/m0/s1
InChIcol:
1
More information (from its Standard Form):
2'-Deoxyadenosine 5'-triphosphate
Complex structures in which this molecule appears :
Complex Structure ID: 1326 Complex Structure ID: 1327 Complex Structure ID: 1328 Complex Structure ID: 1329 Complex Structure ID: 1330
References in which this molecule is mentioned:
Marcus T. Hock, Abigail E. Teitgen, Kimberly J. McCabe, Sophia P. Hirakis, Gary A. Huber, Michael Regnier, Rommie E. Amaro, J. Andrew McCammon, Andrew D. McCulloch. 2023. Multiscale Computational Modeling of the Effects of 2’-deoxy-ATP on Cardiac Muscle Calcium Handling. Journal of Applied Physics None (134). doi: 10.1063/5.0157935.
Image of the Specific State
