Therapeutic Targets Database
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TTD Drug ID: DNC000529

Drug Information
NameDeamido-NAD
IndicationNot AvailableExperimental    
Structure

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InChI1S/C21H26N6O15P2.Na/c22-17-12-18(24-7-23-17)27(8-25-12)20-16(31)1
4(29)11(41-20)6-39-44(36,37)42-43(34,35)38-5-10-13(28)15(30)19(40
-10)26-3-1-2-9(4-26)21(32)33;/h1-4,7-8,10-11,13-16,19-20,28-31H,5
-6H2,(H4-,22,23,24,32,33,34,35,36,37);/p+1
InChIKeySSMFFDBXAUKIMZ-UHFFFAOYSA-O
Canonical SMILESC1=CC(=C[N+](=C1)C2C(C(C(O2)COP(=O)(O)OP(=O)(O)OCC3C(C(C(O3)N4C=NC5=C4N=
CN=C5N)O)O)O)O)C(=O)O.[Na]    
CAS NumberCAS 100659-17-4
PubChem Compound IDCID 16219749.
PubChem Substance IDSID 24897698.
ChEBI18304;
TargetNicotinate-nucleotide adenylyltransferaseBinder[1]
Ref 1Crystal structures of E. coli nicotinate mononucleotide adenylyltransferase and its complex with deamido-NAD. Structure. 2002 Jan;10(1):69-79. To Reference



 

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