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Concept information

organooxygen compound > ester > phosphoric ester > thiamine phosphate > thiamine(1+) monophosphate

Preferred term

thiamine(1+) monophosphate  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • +1

formula

  • C12H18N4O4PS

inchi

  • InChI=1S/C12H17N4O4PS/c1-8-11(3-4-20-21(17,18)19)22-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,7H,3-4,6H2,1-2H3,(H3-,13,14,15,17,18,19)/p+1

inchikey

  • HZSAJDVWZRBGIF-UHFFFAOYSA-O

is_conjugate_acid_of

mass

  • 345.330

monoisotopicmass

  • 345.07809

smiles

  • CC1=C(CCOP(O)(O)=O)SC=[N+]1CC1=C(N)N=C(C)N=C1

subset

  • 3_STAR

synonym EXACT

  • 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-5-[2-(phosphonooxy)ethyl]-1,3-thiazol-3-ium

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:9533

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