Chemical Component Summary

NamePHOSPHORIC ACID 2-AMINO-3-(4-HYDROXY-PHENYL)-PROPYL ESTER ADENOSIN-5'YL ESTER
Identifiers[(2S)-2-amino-3-(4-hydroxyphenyl)propyl] [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methyl phosphate
FormulaC19 H24 N6 O8 P
Molecular Weight495.403
TypeNON-POLYMER
Isomeric SMILESc1cc(ccc1C[C@@H](CO[P@@](=O)([O-])OC[C@@H]2[C@H]([C@H]([C@@H](O2)n3cnc4c3ncnc4N)O)O)N)O
InChIInChI=1S/C19H25N6O8P/c20-11(5-10-1-3-12(26)4-2-10)6-31-34(29,30)32-7-13-15(27)16(28)19(33-13)25-9-24-14-17(21)22-8-23-18(14)25/h1-4,8-9,11,13,15-16,19,26-28H,5-7,20H2,(H,29,30)(H2,21,22,23)/p-1/t11-,13+,15+,16+,19+/m0/s1
InChIKeyJJLCVHBFTXDJMM-KFAHYOAQSA-M

Chemical Details

Formal Charge-1
Atom Count58
Chiral Atom Count5
Bond Count61
Aromatic Bond Count16

Related Resource References

Resource NameReference
PubChem 5289505