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Substance Name: Acetyl coenzyme A
RN: 72-89-9
UNII: 76Q83YLO3O
InChIKey: ZSLZBFCDCINBPY-ZSJPKINUSA-N

Note

  • Acetyl CoA participates in the biosynthesis of fatty acids and sterols, in the oxidation of fatty acids and in the metabolism of many amino acids. It also acts as a biological acetylating agent.

Molecular Formula

  • C23-H38-N7-O17-P3-S

Molecular Weight

  • 809.5732
 

Classification Code

  • Antiviral (COVID-19)
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Names and Synonyms

Name of Substance

  • Acetyl coenzyme A

MeSH Heading

  • Acetyl coenzyme A

Synonyms

  • Acetyl CoA
  • Acetyl coenzyme A
  • EINECS 200-790-9
  • S-Acetyl coenzyme A
  • UNII-76Q83YLO3O

Systematic Names

  • Coenzyme A, S-acetate
  • S-Acetylcoenzyme A

Registry Numbers

CAS Registry Number

  • 72-89-9

FDA UNII

  • 76Q83YLO3O

System Generated Number

  • 0000072899

Structure Descriptors

InChI

InChI=1S/C23H38N7O17P3S/c1-12(31)51-7-6-25-14(32)4-5-26-21(35)18(34)23(2,3)9-44-50(41,42)47-49(39,40)43-8-13-17(46-48(36,37)38)16(33)22(45-13)30-11-29-15-19(24)27-10-28-20(15)30/h10-11,13,16-18,22,33-34H,4-9H2,1-3H3,(H,25,32)(H,26,35)(H,39,40)(H,41,42)(H2,24,27,28)(H2,36,37,38)/t13-,16-,17-,18+,22-/m1/s1

InChIKey

ZSLZBFCDCINBPY-ZSJPKINUSA-N

Smiles

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)n2cnc3c(N)ncnc23