pyridin-1-ium-3,5-dicarboxylate mononucleotide

Chemical Formula:

C₁₂H₁₁NO₁₁P

Molecular Weight:

376.193 Daltons

Monoisotopic Mass:

380.03827183979996 Daltons

SMILES:

C1(C(=CC(C([O-])=O)=C[N+]=1C2(OC(COP([O-])(=O)[O-])C(O)C(O)2))C([O-])=O)

InChI:

1S/C12H14NO11P/c14-8-7(4-23-25(20,21)22)24-10(9(8)15)13-2-5(11(16)17)1-6(3-13)12(18)19/h1-3,7-10,14-15H,4H2,(H3-,16,17,18,19,20,21,22)/p-3/t7-,8-,9-,10-/m1/s1

InChIKey:

QZWRRRIWSQHKCZ-ZYUZMQFOSA-K

Synonyms

P2CMN
pyridinium-3,5-dicarboxylate mononucleotide

Databases

MetaCyc: CPD-20508

ChEBI: 137353

PubChem (CID): 129626625