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Chemistry, part 1

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Concept information

organooxygen compound > carbonyl compound > thioester > acyl-coa > 3-phenylpropanoyl-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 > 3-phenylpropanoyl-coa
organooxygen compound > carboxamide > secondary carboxamide > acyl-coa > 3-phenylpropanoyl-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 > 3-phenylpropanoyl-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 > 3-phenylpropanoyl-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 > 3-phenylpropanoyl-coa
... > organooxygen compound > ester > phosphoric ester > nucleoside phosphate > nucleotide derivative > acyl-coa > 3-phenylpropanoyl-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 > 3-phenylpropanoyl-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 > 3-phenylpropanoyl-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 > 3-phenylpropanoyl-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 > 3-phenylpropanoyl-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 > 3-phenylpropanoyl-coa
... > organic aromatic compound > heteroarene > nucleobase-containing molecular entity > nucleoside phosphate > nucleotide derivative > acyl-coa > 3-phenylpropanoyl-coa
... > organic heterocyclic compound > heteroarene > nucleobase-containing molecular entity > nucleoside phosphate > nucleotide derivative > acyl-coa > 3-phenylpropanoyl-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 > 3-phenylpropanoyl-coa
... > organic heterocyclic compound > organonitrogen heterocyclic compound > imidazopyrimidine > purines > aminopurine > 6-aminopurines > acyl-coa > 3-phenylpropanoyl-coa
... > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > imidazopyrimidine > purines > aminopurine > 6-aminopurines > acyl-coa > 3-phenylpropanoyl-coa
... > organic aromatic compound > heteroarene > imidazopyrimidine > purines > aminopurine > 6-aminopurines > acyl-coa > 3-phenylpropanoyl-coa
... > organic heterocyclic compound > heteroarene > imidazopyrimidine > purines > aminopurine > 6-aminopurines > acyl-coa > 3-phenylpropanoyl-coa

Preferred term

3-phenylpropanoyl-coa  

Type

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

Broader concept

charge

  • 0

formula

  • C30H44N7O17P3S

has_functional_parent

inchi

  • InChI=1S/C30H44N7O17P3S/c1-30(2,25(41)28(42)33-11-10-20(38)32-12-13-58-21(39)9-8-18-6-4-3-5-7-18)15-51-57(48,49)54-56(46,47)50-14-19-24(53-55(43,44)45)23(40)29(52-19)37-17-36-22-26(31)34-16-35-27(22)37/h3-7,16-17,19,23-25,29,40-41H,8-15H2,1-2H3,(H,32,38)(H,33,42)(H,46,47)(H,48,49)(H2,31,34,35)(H2,43,44,45)/t19-,23-,24-,25+,29-/m1/s1

inchikey

  • HYSDRCZPYSOWME-FUEUKBNZSA-N

is_conjugate_acid_of

mass

  • 899.69300

monoisotopicmass

  • 899.17273

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)CCc1ccccc1

subset

  • 3_STAR

synonym EXACT

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

synonym RELATED

  • 3-phenylpropionyl-CoA
  • 3-phenylpropionyl-coenzyme A
  • dihydrocinnamoyl-CoA
  • dihydrocinnamoyl-coenzyme A
  • Phenylpropionyl-coenzyme A

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:85675

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