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Concept information

Preferred term

اگزالیل CoA  

Type

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

alt_id

  • CHEBI:14707
  • CHEBI:25738
  • CHEBI:49814
  • CHEBI:7817

charge

  • 0

formula

  • C23H36N7O19P3S

has_functional_parent

inchi

  • InChI=1S/C23H36N7O19P3S/c1-23(2,16(33)19(34)26-4-3-12(31)25-5-6-53-22(37)21(35)36)8-46-52(43,44)49-51(41,42)45-7-11-15(48-50(38,39)40)14(32)20(47-11)30-10-29-13-17(24)27-9-28-18(13)30/h9-11,14-16,20,32-33H,3-8H2,1-2H3,(H,25,31)(H,26,34)(H,35,36)(H,41,42)(H,43,44)(H2,24,27,28)(H2,38,39,40)/t11-,14-,15-,16+,20-/m1/s1

inchikey

  • QVXMZFTWJVBUHP-IBOSZNHHSA-N

is_conjugate_acid_of

mass

  • 839.55500

monoisotopicmass

  • 839.09995

smiles

  • CC(C)(COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)n1cnc2c(N)ncnc12)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)C(O)=O

subset

  • 3_STAR

synonym EXACT

  • 3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-[(3-{[2-(oxalylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-4-oxobutyl} dihydrogen diphosphate)
  • Oxalyl-CoA

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:15535

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