methylthio-ADP

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 102
Total Number of Articles : 130
PubChem 121990
Molecular Formula

C11H17N5O10P2S

SMILES

CSC1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)N

InChI

InChI=1S/C11H17N5O10P2S/c1-29-11-14-8(12)5-9(15-11)16(3-13-5)10-7(18)6(17)4(25-10)2-24-28(22,23)26-27(19,20)21/h3-4,6-7,10,17-18H,2H2,1H3,(H,22,23)(H2,12,14,15)(H2,19,20,21)/t4-,6-,7-,10-/m1/s1

synonyms
  • 2-MeSADP
  • 34983-48-7
  • 2-methylthio-adenosine-5'-diphosphate
Click to show/hide the synonyms
Properties
Property Value
MW 473.30 g/mol
HBD 6
HBA 15
Rotatable Bond Count 7
Exact Mass 473.01713693 g/mol
Monoisotopic Mass 473.01713693 g/mol
Heavy Atom Count 29
Isotope Atom Count 0
Atom Stereo Count 4
Covalent Unit Count 1
Complexity 688
xlogp -3.8
Topological Polar Surface Area 258