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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > ion > anion > organic anion > organophosphate oxoanion > acyl-coa oxoanion > acyl-coa(4-) > (r,s)-[hydroxy(phenyl)methyl]succinyl-coa(5-)
... > chemical entity > molecular entity > ion > organic ion > organic anion > organophosphate oxoanion > acyl-coa oxoanion > acyl-coa(4-) > (r,s)-[hydroxy(phenyl)methyl]succinyl-coa(5-)
... > 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 > acyl-coa oxoanion > acyl-coa(4-) > (r,s)-[hydroxy(phenyl)methyl]succinyl-coa(5-)
... > 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 > acyl-coa oxoanion > acyl-coa(4-) > (r,s)-[hydroxy(phenyl)methyl]succinyl-coa(5-)
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > phosphorus oxoacid derivative > phosphoric acid derivative > organophosphate oxoanion > acyl-coa oxoanion > acyl-coa(4-) > (r,s)-[hydroxy(phenyl)methyl]succinyl-coa(5-)

Preferred term

(r,s)-[hydroxy(phenyl)methyl]succinyl-coa(5-)  

Type

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

Broader concept

charge

  • -5

formula

  • C32H41N7O20P3S

inchi

  • InChI=1S/C32H46N7O20P3S/c1-32(2,26(45)29(46)35-9-8-20(40)34-10-11-63-31(47)18(12-21(41)42)23(43)17-6-4-3-5-7-17)14-56-62(53,54)59-61(51,52)55-13-19-25(58-60(48,49)50)24(44)30(57-19)39-16-38-22-27(33)36-15-37-28(22)39/h3-7,15-16,18-19,23-26,30,43-45H,8-14H2,1-2H3,(H,34,40)(H,35,46)(H,41,42)(H,51,52)(H,53,54)(H2,33,36,37)(H2,48,49,50)/p-5/t18-,19+,23-,24+,25+,26-,30+/m0/s1

inchikey

  • DVSQFPLMOLPRDU-WCROGVKBSA-I

is_conjugate_base_of

mass

  • 968.690

monoisotopicmass

  • 968.13674

smiles

  • CC(C)(COP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP([O-])([O-])=O)N1C=NC2=C1N=CN=C2N)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)[C@@H](CC([O-])=O)[C@@H](O)C1=CC=CC=C1

subset

  • 3_STAR

synonym EXACT

  • (9R,20S)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonatooxy)tetrahydrofuran-2-yl]-9-hydroxy-20-[(R)-hydroxy(phenyl)methyl]-8,8-dimethyl-3,5-dioxido-10,14,19-trioxo-2,4,6-trioxa-18-thia-11,15-diaza-3,5-diphosphadocosan-22-oate 3,5-dioxide

synonym RELATED

  • (2S)-2-[(R)-hydroxybenzyl]succinyl-CoA pentaanion
  • (2S)-[(R)-hydroxy(phenyl)methyl]succinyl-CoA

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:189059

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