54298-36-1 (NADHX,Adenosine 5'-(trihydrogen diphosphate), P'→5'-ester with (6R)-1,4,5,6-tetrahydro-6-hydroxy-1-β-D-ribofuranosyl-3-pyridinecarboxamide)

快速询单

结构式：

NADHXMOL文件

CAS号：

54298-36-1

中文名称：

NADHX

英文名称：

Adenosine 5'-(trihydrogen diphosphate), P'→5'-ester with (6R)-1,4,5,6-tetrahydro-6-hydroxy-1-β-D-ribofuranosyl-3-pyridinecarboxamide

分子式：

C₂₁H₃₁N₇O₁₅P₂

分子量：

683.4563

NADHX(54298-36-1)名称与标识符

名称

英文别名：

6-hydroxy-1,4,5,6-tetrahydronicotinamide adenine dinucleotide;NADHX;Adenosine 5'-(trihydrogen diphosphate), 5'-5'-ester with 1,4,5,6-tetrahydro-6-hydroxy-1-beta-D-ribofuranosyl-3-pyridinecarboxamide;CID 123131986; NADHX; Monohydroxytetrahydronicotinamide adenine dinucleotide;Adenosine 5'-(trihydrogen diphosphate), P'→5'-ester with 1,4,5,6-tetrahydro-6-hydroxy-1-β-D-ribofuranosyl-3-pyridinecarboxamide, (R)-;Adenosine 5'-(trihydrogen diphosphate), P'→5'-ester with (6R)-1,4,5,6-tetrahydro-6-hydroxy-1-β-D-ribofuranosyl-3-pyridinecarboxamide;54298-36-1;Adenosine 5'-(trihydrogen diphosphate), P'→5'-ester with 1,4,5,6-tetrahydro-6-hydroxy-1-β-D-ribofuranosyl-3-pyridinecarboxamide, (R)-;Monohydroxytetrahydronicotinamide adenine dinucleotide;

标识符

InChIKey：

XDCUYNJYOKOZNK-KKTREJSZSA-N

Inchi：

1S/C21H31N7O15P2/c22-17-12-19(25-6-24-17)28(7-26-12)21-16(33)14(31)10(42-21)5-40-45(37,38)43-44(35,36)39-4-9-13(30)15(32)20(41-9)27-3-8(18(23)34)1-2-11(27)29/h6-10,13-16,20-21,30-33H,1-5H2,(H2,23,34)(H,35,36)(H,37,38)(H2,22,24,25)/t8?,9-,10-,13-,14-,15-,16-,20-,21-/m1/s1

SMILES：

P(=O)(O[H])(OP(=O)([O-])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])OC([H])([H])[C@]1([H])[C@]([H])([C@]([H])([C@]([H])([N+]2([H])C(C([H])([H])C([H])([H])C([H])(C(N([H])[H])=O)C2([H])[H])=O)O1)O[H])O[H]