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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > fatty acid derivative > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa
... > organooxygen compound > carbonyl compound > thioester > acyl-coa > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > secondary carboxamide > acyl-coa > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa
... > organooxygen compound > carboxamide > secondary carboxamide > acyl-coa > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > secondary carboxamide > acyl-coa > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > phosphorus molecular entity > phosphorus oxoacids and derivatives > phosphorus oxoacid derivative > phosphoric acid derivative > phosphoric ester > nucleoside phosphate > nucleotide derivative > acyl-coa > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > phosphorus oxoacid derivative > phosphoric acid derivative > phosphoric ester > nucleoside phosphate > nucleotide derivative > acyl-coa > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa
... > organooxygen compound > ester > phosphoric ester > nucleoside phosphate > nucleotide derivative > acyl-coa > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > phosphorus molecular entity > phosphorus oxoacids and derivatives > phosphorus oxoacid derivative > phosphoric acid derivative > organic phosphate > nucleoside phosphate > nucleotide derivative > acyl-coa > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > phosphorus oxoacid derivative > phosphoric acid derivative > organic phosphate > nucleoside phosphate > nucleotide derivative > acyl-coa > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > phosphorus molecular entity > phosphorus oxoacids and derivatives > phosphorus oxoacid derivative > phosphoric acid derivative > phosphate > organic phosphate > nucleoside phosphate > nucleotide derivative > acyl-coa > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > phosphorus oxoacid derivative > phosphoric acid derivative > phosphate > organic phosphate > nucleoside phosphate > nucleotide derivative > acyl-coa > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > nucleobase-containing molecular entity > nucleoside phosphate > nucleotide derivative > acyl-coa > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa
... > organic aromatic compound > heteroarene > nucleobase-containing molecular entity > nucleoside phosphate > nucleotide derivative > acyl-coa > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa
... > organic heterocyclic compound > heteroarene > nucleobase-containing molecular entity > nucleoside phosphate > nucleotide derivative > acyl-coa > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > imidazopyrimidine > purines > aminopurine > 6-aminopurines > acyl-coa > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa
... > organic heterocyclic compound > organonitrogen heterocyclic compound > imidazopyrimidine > purines > aminopurine > 6-aminopurines > acyl-coa > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa
... > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > imidazopyrimidine > purines > aminopurine > 6-aminopurines > acyl-coa > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa
... > organic aromatic compound > heteroarene > imidazopyrimidine > purines > aminopurine > 6-aminopurines > acyl-coa > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa
... > organic heterocyclic compound > heteroarene > imidazopyrimidine > purines > aminopurine > 6-aminopurines > acyl-coa > fatty acyl-coa > oxo-fatty acyl-coa > 3-oxo-fatty acyl-coa > 2-oxocyclohexane-1-carbonyl-coa

Preferred term

2-oxocyclohexane-1-carbonyl-coa  

Type

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

Broader concept

alt_id

  • CHEBI:1181
  • CHEBI:19670

charge

  • 0

formula

  • C28H44N7O18P3S

has_functional_parent

inchi

  • InChI=1S/C28H44N7O18P3S/c1-28(2,22(39)25(40)31-8-7-18(37)30-9-10-57-27(41)15-5-3-4-6-16(15)36)12-50-56(47,48)53-55(45,46)49-11-17-21(52-54(42,43)44)20(38)26(51-17)35-14-34-19-23(29)32-13-33-24(19)35/h13-15,17,20-22,26,38-39H,3-12H2,1-2H3,(H,30,37)(H,31,40)(H,45,46)(H,47,48)(H2,29,32,33)(H2,42,43,44)/t15?,17-,20-,21-,22+,26-/m1/s1

inchikey

  • BGLNPJARTQOCKR-OXXAVVHVSA-N

mass

  • 891.67262

monoisotopicmass

  • 891.16764

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)C1CCCCC1=O

subset

  • 3_STAR

synonym EXACT

  • 2-Oxocyclohexane-1-carbonyl-CoA
  • 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(2-oxocyclohexane-1-carbonyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}

synonym RELATED

  • 2-Ketocyclohexane-1-carbonyl-CoA
  • 2-ketocyclohexane-1-carbonyl-coenzyme A
  • 2-Ketocyclohexane-1-carboxyl-CoA
  • 2-ketocyclohexanecarbonyl-CoA
  • 2-ketocyclohexanecarboxyl-CoA
  • 2-oxocyclohexane-1-carbonyl-coenzyme A
  • 2-oxocyclohexane-1-carboxyl-CoA
  • 2-oxocyclohexanecarbonyl-CoA
  • 2-oxocyclohexanecarboxyl-CoA
  • 2-oxocyclohexanecarboxyl-coenzyme A

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:27664

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