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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > ion > anion > organic anion > organophosphate oxoanion > phosphopantetheine anion > s-acyl-4'-phosphopantetheine(2-) > s-hexanoyl-4'-phosphopantetheine(2-)
... > chemical entity > molecular entity > ion > organic ion > organic anion > organophosphate oxoanion > phosphopantetheine anion > s-acyl-4'-phosphopantetheine(2-) > s-hexanoyl-4'-phosphopantetheine(2-)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic ion > organic anion > organophosphate oxoanion > phosphopantetheine anion > s-acyl-4'-phosphopantetheine(2-) > s-hexanoyl-4'-phosphopantetheine(2-)
... > 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 > organophosphate oxoanion > phosphopantetheine anion > s-acyl-4'-phosphopantetheine(2-) > s-hexanoyl-4'-phosphopantetheine(2-)
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > phosphorus oxoacid derivative > phosphoric acid derivative > organophosphate oxoanion > phosphopantetheine anion > s-acyl-4'-phosphopantetheine(2-) > s-hexanoyl-4'-phosphopantetheine(2-)

Preferred term

s-hexanoyl-4'-phosphopantetheine(2-)  

Type

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

Broader concept

charge

  • -2

formula

  • C17H31N2O8PS

inchi

  • InChI=1S/C17H33N2O8PS/c1-4-5-6-7-14(21)29-11-10-18-13(20)8-9-19-16(23)15(22)17(2,3)12-27-28(24,25)26/h15,22H,4-12H2,1-3H3,(H,18,20)(H,19,23)(H2,24,25,26)/p-2/t15-/m0/s1

inchikey

  • KGMBPSVUBJAAEN-HNNXBMFYSA-L

is_conjugate_base_of

mass

  • 454.477

monoisotopicmass

  • 454.15497

smiles

  • C(NC(CCNC(=O)[C@@H](C(COP([O-])(=O)[O-])(C)C)O)=O)CSC(=O)CCCCC

subset

  • 3_STAR

synonym EXACT

  • N-[2-(hexanoylsulfanyl)ethyl]-N(3)-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonatooxy)butanoyl]-beta-alaninamide

synonym RELATED

  • caproyl-4'-phosphopantetheine(2-)
  • hexanoyl-4'-phosphopantetheine
  • hexanoyl-4'-phosphopantetheine(2-)
  • S-caproyl-4'-phosphopantetheine(2-)

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:132012

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