865-05-4 (NAD cation,Adenosine 5'-(trihydrogen diphosphate), P'→5'-ester with 3-(aminocarbonyl)-1-β-D-ribofuranosylpyridinium)

快速询单

结构式：

NAD cationMOL文件

CAS号：

865-05-4

中文名称：

NAD cation

英文名称：

Adenosine 5'-(trihydrogen diphosphate), P'→5'-ester with 3-(aminocarbonyl)-1-β-D-ribofuranosylpyridinium

分子式：

C₂₁H₂₈N₇O₁₄P₂

分子量：

664.433

NAD cation(865-05-4)名称与标识符

名称

英文别名：

beta-NAD(+);beta-NAD+;beta-NADP+;NAD(+);NAD(1+);NAD+;NADP+; NAD ion(1+) ; NAD cation;Pyridinium, 3-carbamoyl-1-β-D-ribofuranosyl-, 5'→5'-ester with adenosine 5'-(trihydrogen pyrophosphate) (8CI);Adenosine 5'-(trihydrogen diphosphate), P'→5'-ester with 3-(aminocarbonyl)-1-β-D-ribofuranosylpyridinium;KBio2_001453;865-05-4;1-[5-O-[(5'-Adenylyloxy)phosphonyl]-beta-D-ribofuranosyl]-3-(aminocarbonyl)pyridinium;KBio2_006589;IDI1_000189;SR-05000001677-3;Q26987253;Adenine-nicotinamide dinucleotide;BAWFJGJZGIEFAR-NNYOXOHSSA-O;C21H27N7O14P2;SCHEMBL14478781;Adenosine 5'-(trihydrogen diphosphate), P'?5'-ester with 3-(aminocarbonyl)-1-.beta.-D-ribofuranosylpyridinium, inner salt;CHEMBL3039307;TXE;[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate;KBio2_004021;diphosphopyridine nucleotide;adenosine 5'-{3-[1-(3-carbamoylpyridinio)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate};Spectrum3_000511;BSPBio_002061;BSPBio_000722;NINDS_000189;BPBio1_000796;151411-04-0;[[(2~{R},3~{S},4~{R},5~{R})-5-(3-aminocarbonylpyridin-1-ium-1-yl)-4-[[5-[4-cyano-2-[(~{E})-hydroxyiminomethyl]phenoxy]-1-oxidanyl-3~{H}-2,1$l^{4}-benzoxaborol-1-yl]oxy]-3-oxidanyl-oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl hydrogen phosphate;65085-09-8;Spectrum4_000065;PD062453;Nicotinamide adenine dinucleotide (NAD+);Prestwick3_000741;KBio1_000189;Spectrum5_001291;SR-05000001677;KBioGR_000589;BRD-A11132253-001-01-7;D00002;SPBio_001012;bmse000053;CHEBI:15846;beta-nicotinamide adenine dinucleotide;Nicotinamide-Adenine-Dinucleotide;53-84-9;SR-05000001677-1;9JM;DivK1c_000189;Nadide (JAN/USAN/INN);COZYMASE;121053-11-0;KBio3_001561;NAD cation;Spectrum2_001056;codehydrogenase;C21-H27-N7-O14-P2;nicotinamide adenine dinucleotide;[[(2r,3s,4r,5r)-5-[(3r)-3-Aminocarbonyl-3,4-Dihydro-2h-Pyridin-1-Yl]-3,4-Bis(Oxidanyl)oxolan-2-Yl]methoxy-Oxidanidyl-Phosphoryl] [(2r,3s,4r,5r)-5-(6-Aminopurin-9-Yl)-3,4-Bis(Oxidanyl)oxolan-2-Yl]methyl Phosphate;Spectrum_000973;Nadide [USAN:BAN:INN:JAN];Nicotinamide-adenine dinucleotide;C00003;NAJ;KBioSS_001453;Adenosine 5'-(trihydrogen diphosphate), 5'.fwdarw.5'-ester with 3-(aminocarbonyl)-1-.beta.-D-ribofuranosylpyridinium hydroxide, inner salt;nadide;NAD ion(1+);

标识符

InChIKey：

BAWFJGJZGIEFAR-NNYOXOHSSA-O

Inchi：

InChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1

SMILES：

O=P(O)(OP(O)(OC[C@@H]1[C@@H](O)[C@@H](O)[C@@H](O1)N2C=NC3=C(N=CN=C32)N)=O)OC[C@H]4O[C@H]([C@@H]([C@@H]4O)O)[N+]5=CC=CC(C(N)=O)=C5