Compound Details

 Compound-ID 2784
 Common Name 3-Carboxy-1-hydroxypropyl-ThPP
 InChI InChI=1S/C16H24N4O10P2S/c1-9-13(5-6-29-32(27,28)30-31(24,25)26)33-16(12(21)3-4-14(22)23)20(9)8-11-7-18-10(2)19-15(11)17/h7,12,21H,3-6,8H2,1-2H3,(H5-,17,18,19,22,23,24,25,26,27,28)/p+1
 SMILES Cc2ncc(Cn1c(C)c(CCOP(O)(=O)OP(O)(O)=O)sc1(C(O)CCC(O)=O))c(N)n2
 External Links
 KEGG-COMPOUND-ID C05381
 PUBCHEM-ID 7755
 ChEBI-ID 1463
 BioModels 1463


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