1-hydroxy-2-methylbutyl-thiamine pyrophosphate


InChI: InChI=1/C17H28N4O7P2S/c1-5-10(2)15(22)17-21(9-13-8-19-12(4)20-16(13)18)11(3)14(31-17)6-7-29(23,24)28-30(25,26)27/h8,10,15,22H,5-7,9H2,1-4H3,(H4-,18,19,20,23,24,25,26,27)/p+1

InChIKey: InChIKey=MOEKSHHMFNQKPI-IKLDFBCSAK
SMILES: CCC(C)C(O)C1=[N+](CC2=C(N)N=C(C)N=C2)C(C)=C(CCP(O)(=O)OP(O)(O)=O)S1

Names:
    1-hydroxy-2-methylbutyl-thiamine diphosphate
    1-hydroxy-2-methylbutyl-thiamine pyrophosphate
    2-methyl-1-hydroxybutylthiamine diphosphate
    2-methyl-1-hydroxybutyl-thiamine diphosphate
    2-methyl-1-hydroxybutyl-thiamine pyrophosphate
    3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-diphosphoethyl)-2-(1-hydroxy-

Registries:
    PubChem CID 1949248824
    ChEBI 29141