主记录
NGD+
- CAS
- 5624-35-1
- PubChem CID
- 135404873
- SMILES
- C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)([O-])OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C4N=C(NC5=O)N)O)O)O)O)C(=O)N
- 分子式
- C21H27N7O15P2
- 分子量
- 679.429
- 精确分子量
- 679.104
- InChI
- InChI=1S/C21H27N7O15P2/c22-16(33)8-2-1-3-27(4-8)19-14(31)12(29)9(41-19)5-39-44(35,36)43-45(37,38)40-6-10-13(30)15(32)20(42-10)28-7-24-11-17(28)25-21(23)26-18(11)34/h1-4,7,9-10,12-15,19-20,29-32H,5-6H2,(H6-,22,23,25,26,33,34,35,36,37,38)/t9-,10-,12-,13-,14-,15-,19-,20-/m1/s1
- InChIKey
- NCFRZZVNRVEQJK-NAJQWHGHSA-N
- LogP
- -4.3546
- TPSA
- 341.06
名称与别名
- NGD+
- orb65254
- Nicotinamide guanine dinucleotide
- Nicotinamideguaninedinucleotidesodiumsalt
- CID10919497
- CID 10919497
- J788.134G
- Nicotinamide guanine dinucleotide sodium salt
- 5624-35-1
- 1-[(2R,3R,4S,5R)-5-{[({[(2R,3S,4R,5R)-5-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl phosphonato)oxy]methyl}-3,4-dihydroxyoxolan-2-yl]-3-carbamoyl-1lambda5-pyridin-1-ylium
- 3-(Aminocarbonyl)-1-[5-O-[(5 -guanylyloxy)oxylatophosphinyl]-beta-D-ribofuranosyl]pyridinium