Marvin 08060811402D 22 23 0 0 1 0 999 V2000 0.7145 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.8250 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7145 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -1.6500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6674 -2.1349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6674 -2.1349 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4125 -2.9195 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4125 -2.9195 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4521 -1.8800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8974 -3.5870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8974 -3.5870 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 0.4125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5619 -4.3407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7994 -5.0551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5619 -5.7696 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9744 -5.0551 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 -0.1494 -5.0551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 2 1 2 0 0 0 0 3 2 1 0 0 0 0 7 3 1 1 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 1 6 1 0 0 0 0 7 8 1 0 0 0 0 9 7 1 0 0 0 0 10 8 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 6 0 0 0 10 13 1 1 0 0 0 11 10 1 0 0 0 0 11 14 1 6 0 0 0 13 18 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 21 1 0 0 0 0 21 19 2 0 0 0 0 21 20 1 0 0 0 0 21 22 1 0 0 0 0 M CHG 2 3 1 20 -1 M END > CHEBI:16171 > NMN zwitterion > 3 > CHEBI:14647; CHEBI:12397; CHEBI:7557; CHEBI:13409; CHEBI:18201; CHEBI:14646; CHEBI:10433; CHEBI:25522; CHEBI:22850 > NMN; Nicotinamide ribonucleotide; Nicotinamide nucleotide; Nicotinamide mononucleotide; Nicotinamide D-ribonucleotide; beta-Nicotinamide ribonucleotide; beta-Nicotinamide mononucleotide; beta-Nicotinamide D-ribonucleotide; 3-(aminocarbonyl)-1-(5-O-phosphono-beta-D-ribofuranosyl)pyridinium, inner salt; 3-(aminocarbonyl)-1-(5-O-phosphonato-beta-D-ribofuranosyl)pyridinium > 3-carbamoyl-1-[5-O-(hydroxyphosphinato)-beta-D-ribofuranosyl]pyridinium > C11H15N2O8P > 334.21924 > 334.05660 > 0 > NC(=O)c1ccc[n+](c1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O > InChI=1S/C11H15N2O8P/c12-10(16)6-2-1-3-13(4-6)11-9(15)8(14)7(21-11)5-20-22(17,18)19/h1-4,7-9,11,14-15H,5H2,(H3-,12,16,17,18,19)/t7-,8-,9-,11-/m1/s1 > DAYLJWODMCOQEW-TURQNECASA-N > 3570187 > 1094-61-7 > 1094-61-7 > C00455 > C00019694 > NMN $$$$