Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Carboxymethyl-coenzyme A
RN: 79955-48-9
InChIKey: OBUOSIHPWVNVJN-GRFIIANRSA-N

Molecular Formula

  • C23-H38-N7-O18-P3-S

Molecular Weight

  • 825.5722
 
* 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

  • Carboxymethyl-coenzyme A

Synonyms

  • Carboxymethyl-coa
  • Coenzyme A, carboxymethyl-

Systematic Name

  • Coenzyme A, S-(carboxymethyl)-

Registry Numbers

CAS Registry Number

  • 79955-48-9

System Generated Number

  • 0079955489

Structure Descriptors

InChI

1S/C23H38N7O18P3S/c1-23(2,18(35)21(36)26-4-3-13(31)25-5-6-52-8-14(32)33)9-45-51(42,43)48-50(40,41)44-7-12-17(47-49(37,38)39)16(34)22(46-12)30-11-29-15-19(24)27-10-28-20(15)30/h10-12,16-18,22,34-35H,3-9H2,1-2H3,(H,25,31)(H,26,36)(H,32,33)(H,40,41)(H,42,43)(H2,24,27,28)(H2,37,38,39)/t12-,16-,17-,18+,22-/m1/s1

InChIKey

OBUOSIHPWVNVJN-GRFIIANRSA-N

Smiles

CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSCC(=O)O)O