3-Aminopyridine adenine dinucleotide(21106-96-7)名称与标识符
名称
英文别名:
3-aminopyridine adenine dinucleotide;LogP; 3-Aminopyridine adenine dinucleotide
; Adenosine 5'-(trihydrogen pyrophosphate),
5'→5'-ester with 3-amino-1-β-D-ribofuranosylpyridinium hydroxide, inner salt (8CI); Pyridinium, 3-amino-1-β-
D-ribofuranosyl-, hydroxide, 5'→5'-ester with adenosine 5'-(trihydrogen pyrophosphate), inner salt (8CI);3-Amino-1-β-D-ribofuranosylpyridinium hydroxide, inner salt, 5'-ester with adenosine 5-diphosphate (6CI);Adenosine 5'-(trihydrogen diphosphate), P'→5'-ester with 3-amino-1-β-D-ribofuranosylpyridinium, inner salt;3-Apadn;Adenosine 5'-(trihydrogen diphosphate), P'-5'-ester with 3-amino-1-beta-D-ribofuranosylpyridinium inner salt;21106-96-7;(2R,3R,4S,5R)-5-[[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxymethyl]-2-(3-aminopyridin-1-ium-1-yl)-4-hydroxyoxolan-3-olate;Pyridinium, 3-amino-1-β-D-ribofuranosyl-, hydroxide, 5'→5'-ester with adenosine 5'-(trihydrogen pyrophosphate), inner salt (8CI);Adenosine 5'-(trihydrogen pyrophosphate), 5'→5'-ester with 3-amino-1-β-D-ribofuranosylpyridinium hydroxide, inner salt (8CI);
标识符
InChIKey:
NKCBLVMXMCSJQL-HISDBWNOSA-N
Inchi:
1S/C20H27N7O13P2/c21-9-2-1-3-26(4-9)19-15(30)13(28)10(38-19)5-36-41(32,33)40-42(34,35)37-6-11-14(29)16(31)20(39-11)27-8-25-12-17(22)23-7-24-18(12)27/h1-4,7-8,10-11,13-16,19-20,28-29,31H,5-6,21H2,(H,32,33)(H,34,35)(H2,22,23,24)/t10-,11-,13-,14-,15-,16-,19-,20-/m1/s1
SMILES:
P(=O)(O[H])(OP(=O)(O[H])OC([H])([H])[C@]1([H])[C@]([H])([C@]([H])([C@]([H])([N+]2=C([H])C([H])=C([H])C(=C2[H])N([H])[H])O1)[O-])O[H])OC([H])([H])[C@]1([H])[C@]([H])([C@]([H])([C@]([H])(N2C([H])=NC3=C(N([H])[H])N=C([H])N=C23)O1)O[H])O[H]