Density: 1.76±0.1 g/cm3
InChIKey: JHPPUZXTSWNMKQ-LDAIXZEYSA-N
CanonicalSMILES: O=C1NC2CSC(CCCCC(=O)NCCCCCCNC3=NC=NC4=C3N=CN4C5OC(COP(=O)(O)O)C(O)C5O)C2N1
IUPAC Name: ((2R,3S,4R,5R)-3,4-dihydroxy-5-(6-((6-(5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamido)hexyl)amino)-9H-purin-9-yl)tetrahydrofuran-2-yl)methyl dihydrogen phosphate
InChI: InChI=1S/C26H41N8O9PS/c35-18(8-4-3-7-17-19-15(12-45-17)32-26(38)33-19)27-9-5-1-2-6-10-28-23-20-24(30-13-29-23)34(14-31-20)25-22(37)21(36)16(43-25)11-42-44(39,40)41/h13-17,19,21-22,25,36-37H,1-12H2,(H,27,35)(H,28,29,30)(H2,32,33,38)(H2,39,40,41)/t15-,16+,17-,19-,21+,22+,25+/m0/s1
Synonyms: N6-(6-hexylamidobiotin)-adenosine-5'-monophosphate; 5'-Adenylic acid, N-[6-[[5-[(3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl]-1-oxopentyl]amino]hexyl]-