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Chemistry, part 1

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Concept information

organooxygen compound > carbonyl compound > thioester > acyl-coa > 3-oxo-5,6-dehydrosuberyl-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-oxo-5,6-dehydrosuberyl-coa
organooxygen compound > carboxamide > secondary carboxamide > acyl-coa > 3-oxo-5,6-dehydrosuberyl-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-oxo-5,6-dehydrosuberyl-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-oxo-5,6-dehydrosuberyl-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-oxo-5,6-dehydrosuberyl-coa
... > organooxygen compound > ester > phosphoric ester > nucleoside phosphate > nucleotide derivative > acyl-coa > 3-oxo-5,6-dehydrosuberyl-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-oxo-5,6-dehydrosuberyl-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-oxo-5,6-dehydrosuberyl-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-oxo-5,6-dehydrosuberyl-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-oxo-5,6-dehydrosuberyl-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-oxo-5,6-dehydrosuberyl-coa
... > organic aromatic compound > heteroarene > nucleobase-containing molecular entity > nucleoside phosphate > nucleotide derivative > acyl-coa > 3-oxo-5,6-dehydrosuberyl-coa
... > organic heterocyclic compound > heteroarene > nucleobase-containing molecular entity > nucleoside phosphate > nucleotide derivative > acyl-coa > 3-oxo-5,6-dehydrosuberyl-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-oxo-5,6-dehydrosuberyl-coa
... > organic heterocyclic compound > organonitrogen heterocyclic compound > imidazopyrimidine > purines > aminopurine > 6-aminopurines > acyl-coa > 3-oxo-5,6-dehydrosuberyl-coa
... > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > imidazopyrimidine > purines > aminopurine > 6-aminopurines > acyl-coa > 3-oxo-5,6-dehydrosuberyl-coa
... > organic aromatic compound > heteroarene > imidazopyrimidine > purines > aminopurine > 6-aminopurines > acyl-coa > 3-oxo-5,6-dehydrosuberyl-coa
... > organic heterocyclic compound > heteroarene > imidazopyrimidine > purines > aminopurine > 6-aminopurines > acyl-coa > 3-oxo-5,6-dehydrosuberyl-coa

Preferred term

3-oxo-5,6-dehydrosuberyl-coa  

Type

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

Broader concept

charge

  • 0

formula

  • C29H44N7O20P3S

inchi

  • InChI=1S/C29H44N7O20P3S/c1-29(2,24(43)27(44)32-8-7-18(38)31-9-10-60-20(41)11-16(37)5-3-4-6-19(39)40)13-53-59(50,51)56-58(48,49)52-12-17-23(55-57(45,46)47)22(42)28(54-17)36-15-35-21-25(30)33-14-34-26(21)36/h3-4,14-15,17,22-24,28,42-43H,5-13H2,1-2H3,(H,31,38)(H,32,44)(H,39,40)(H,48,49)(H,50,51)(H2,30,33,34)(H2,45,46,47)/t17-,22-,23-,24+,28-/m1/s1

inchikey

  • IFFFDKYRRUVOFP-NOQDIWQESA-N

is_conjugate_acid_of

mass

  • 935.68100

monoisotopicmass

  • 935.15747

smiles

  • [H]C(CC(O)=O)=C([H])CC(=O)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(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

subset

  • 3_STAR

synonym RELATED

  • 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[3-oxo-5,6-dehydro-7-carboxyheptanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:63253

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