Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: N-6-(N-(6-Aminohexyl)carbamoylmethyl)-NAD
RN: 52213-58-8
InChIKey: GABPYIIHWMAIPB-QEFSYXKZSA-N

Molecular Weight

  • 819.655
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • N-6-(N-(6-Aminohexyl)carbamoylmethyl)-NAD

Synonyms

  • N-Acnad
  • Nicotinamide-N(6)-(N-(6-aminohexyl)carbamoylmethyl)adenine dinucleotide

Systematic Name

  • Adenosine 5'-(trihydrogen diphosphate), N-(2-((6-aminohexyl)amino)-2-oxoethyl)-, 5'-5'-ester with 3-(aminocarbonyl)-1-beta-D-ribofuranosylpyridinium hydroxide, inner salt

Registry Numbers

CAS Registry Number

  • 52213-58-8

System Generated Number

  • 0052213588

Structure Descriptors

InChI

1S/C29H43N9O15P2/c30-7-3-1-2-4-8-32-19(39)10-33-26-20-27(35-14-34-26)38(15-36-20)29-24(43)22(41)18(52-29)13-50-55(47,48)53-54(45,46)49-12-17-21(40)23(42)28(51-17)37-9-5-6-16(11-37)25(31)44/h5-6,9,11,14-15,17-18,21-24,28-29,40-41,43H,1-4,7-8,10,12-13,30H2,(H2,31,44)(H,32,39)(H,45,46)(H,47,48)(H,33,34,35)/t17-,18-,21-,22-,23-,24-,28-,29-/m1/s1

InChIKey

GABPYIIHWMAIPB-QEFSYXKZSA-N

Smiles

c1c(C(=O)N)ccc[n+]1[C@H]1[C@H]([O-])[C@H](O)[C@H](O1)CO[P@@](=O)(O)O[P@@](=O)(O)OC[C@@H]1[C@@H](O)[C@@H](O)[C@@H](O1)n1cnc2c(NCC(=O)NCCCCCCN)ncnc12