The Biofilms Structural Database |
ADP |
|
---|---|
5EXT |
|
Code
ADP | |
Name |
ADENOSINE-5'-DIPHOSPHATE |
Molecular Weight |
427.2 |
Isomeric SMILES |
Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO[P@@](O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O |
Formula |
C10H15N5O10P2 |
Identifiers |
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methyl phosphono hydrogen phosphate |
Formal Charge |
0 |
InChI |
InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1 |
Atom Count |
42 |
InChIKey |
XTWYTFMLZFPYCI-KQYNXXCUSA-N |
PDB codes |
5EXT, 5YA2 |
Type |
NON-POLYMER |
Chiral Atom Count |
5 |
Chiral Atoms |
C1', C2', C3', C4', PA |
Bond Count |
44 |
Aromatic Bond Count |
10 |
Leaving Atoms |
n/a |