Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Methoxycarbonyl-coenzyme A disulfide
RN: 72205-57-3
InChIKey: MGXAHWZPOYQYBM-UHFFFAOYSA-N

Molecular Weight

  • 857.638
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Methoxycarbonyl-coenzyme A disulfide

Synonyms

  • Methoxycarbonyl coa disulfide
  • Methoxycarbonyl coenzyme A disulfide

Systematic Name

  • Coenzyme A, S-(O-methyl carbono(dithioperoxoate))

Registry Numbers

CAS Registry Number

  • 72205-57-3

System Generated Number

  • 0072205573

Structure Descriptors

InChI

1S/C23H38N7O18P3S2/c1-23(2,17(33)20(34)26-5-4-13(31)25-6-7-52-53-22(35)43-3)9-45-51(41,42)48-50(39,40)44-8-12-16(47-49(36,37)38)15(32)21(46-12)30-11-29-14-18(24)27-10-28-19(14)30/h10-12,15-17,21,32-33H,4-9H2,1-3H3,(H,25,31)(H,26,34)(H,39,40)(H,41,42)(H2,24,27,28)(H2,36,37,38)

InChIKey

MGXAHWZPOYQYBM-UHFFFAOYSA-N

Smiles

COC(SSCCNC(CCNC([C@@H](C(CO[P@@](=O)(O)O[P@@](=O)(O)OC[C@@H]1O[C@@H](n2cnc3c(ncnc23)N)[C@@H](O)[C@@H]1OP(O)(=O)O)(C)C)O)=O)=O)=O