N6-2AE-NAD(59587-50-7)名称与标识符
名称
英文别名:
(2R,3R,4R,5R)-5-({[{[{[(2R,3S,4R,5R)-5-{6-[(2-aminoethyl)amino]-9H-purin-9-yl}-3,4-dihydroxytetrahydrofuran-2-yl]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]oxy}methyl)-2-(3-carbamoylpyridinium-1-yl)-4-hydroxytetrahydrofuran-3-olate (non-preferred;(2R,3R,4R,5R)-5-({[{[{[(2R,3S,4R,5R)-5-{6-[(2-aminoethyl)amino]-9H-purin-9-yl}-3,4-dihydroxytetrahydrofuran-2-yl]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]oxy}methyl)-2-(3-carbamoylpyridiniu;Nicotinamide-6(2-aminoethylamino)purine dinucleotide;(2R,3R,4S,5R)-5-[[[[(2R,3S,4R,5R)-5-[6-(2-aminoethylamino)purin-9-yl]-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxymethyl]-2-(3-carbamoylpyridin-1-ium-1-yl)-4-hydroxyoxolan-3-olate;nicotinamide 6-(2-aminoethylamino) purine dinucleotide;nicotinamide 6-(2-aminoethylamino)purine dinucleotide;Adenosine-5'-(trihydrogen diphosphate), N-(2-aminoethyl)-, 5'-5'-ester with 3-(aminocarbonyl)-1-beta-D-ribofuranosy; Nicotinamide 6-(2-aminoethylamino)purine dinucleotide
; N6-2AE-NAD;N6-(2-Aminoethyl)-NAD;Adenosine 5'-(trihydrogen diphosphate), N-(2-aminoethyl)-, P'→5'-ester with 3-(aminocarbonyl)-1-β-D-ribofuranosylpyridinium, inner salt;Adenosine-5'-(trihydrogen diphosphate), N-(2-aminoethyl)-, 5'-5'-ester with 3-(aminocarbonyl)-1-beta-D-ribofuranosylpyridinium hydroxide, inner salt;59587-50-7;SPEHZVWWLGJQLD-BSLNIGMPSA-N;N6-2AE-NAD;
标识符
InChIKey:
SPEHZVWWLGJQLD-BSLNIGMPSA-N
Inchi:
1S/C23H32N8O14P2/c24-3-4-26-20-14-21(28-9-27-20)31(10-29-14)23-18(35)16(33)13(44-23)8-42-47(39,40)45-46(37,38)41-7-12-15(32)17(34)22(43-12)30-5-1-2-11(6-30)19(25)36/h1-2,5-6,9-10,12-13,15-18,22-23,32-33,35H,3-4,7-8,24H2,(H2,25,36)(H,37,38)(H,39,40)(H,26,27,28)/t12-,13-,15-,16-,17-,18-,22-,23-/m1/s1
SMILES:
P(=O)(O)(OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@H]([N+]2C=CC=C(C(N)=O)C=2)O1)[O-])O)OC[C@@H]1[C@H]([C@H]([C@H](N2C=NC3C(NCCN)=NC=NC2=3)O1)O)O