CNA

CARBA-NICOTINAMIDE-ADENINE-DINUCLEOTIDE

Find entries where: CNA

is present as a standalone ligand in 16 entries

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Chemical Component Summary
Name	CARBA-NICOTINAMIDE-ADENINE-DINUCLEOTIDE
Identifiers	[[(1R,2R,3S,4R)-4-(3-aminocarbonylpyridin-1-ium-1-yl)-2,3-bis(oxidanyl)cyclopentyl]methoxy-oxidanyl-phosphoryl] [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl hydrogen phosphate
Formula	C₂₂ H₃₀ N₇ O₁₃ P₂
Molecular Weight	662.46
Type	NON-POLYMER
Isomeric SMILES	c1cc(c[n+](c1)[C@@H]2C[C@@H]([C@H]([C@H]2O)O)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)n4cnc5c4ncnc5N)O)O)C(=O)N
InChI	InChI=1S/C22H29N7O13P2/c23-19-14-21(26-8-25-19)29(9-27-14)22-18(33)17(32)13(41-22)7-40-44(37,38)42-43(35,36)39-6-11-4-12(16(31)15(11)30)28-3-1-2-10(5-28)20(24)34/h1-3,5,8-9,11-13,15-18,22,30-33H,4,6-7H2,(H5-,23,24,25,26,34,35,36,37,38)/p+1/t11-,12-,13-,15-,16+,17-,18-,22-/m1/s1
InChIKey	DGPLSUKWXXSBCU-VGXGLJSLSA-O

Chemical Details
Formal Charge	1
Atom Count	74
Chiral Atom Count	8
Bond Count	78
Aromatic Bond Count	16

Drug Info: DrugBank

DrugBank ID	DB02498
Name	Carba-nicotinamide-adenine-dinucleotide
Groups	experimental
Synonyms	Carba-nicotinamide-adenine-dinucleotide

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Poly [ADP-ribose] polymerase 1	MAESSDKLYRVEYAKSGRASCKKCSESIPKDSLRMAIMVQSPMFDGKVPH...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682