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alpha-NAD(1-)

PropertiesImageOccurences in reactions
MNX_IDMNXM166986Image of MNXM166986
#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
formulaC21H26N7O14P2
charge-1
mass662.10185
referencechebi:77017
InChIKeyBAWFJGJZGIEFAR-OPDHFMQKSA-M
InChIInChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p-1/t10-,11-,13-,14-,15-,16-,20+,21-/m1/s1
SMILESNC(=O)c1ccc[n+]([C@H]2O[C@H](COP(=O)([O-])OP(=O)([O-])OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:77017
chebi:77017
alpha-NAD(1-)
CHEBI:77173
chebi:77173
alpha-NAD(+)
sabiork.compound:26127
sabiorkM:26127
metacyc.compound:CPD-16008
metacycM:CPD-16008
seed.compound:cpd32402
seedM:cpd32402
alpha-NAD+
seedM:M_cpd32402 secondary/obsolete/fantasy identifier