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Substance Name: Stearoyl-(1,N(6))-etheno-coenzyme A
RN: 73945-37-6
InChIKey: QVYSJHMIKDJAPR-UHFFFAOYSA-N

Molecular Weight

  • 1058.02
 
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Names and Synonyms

Name of Substance

  • Stearoyl-(1,N(6))-etheno-coenzyme A

Synonyms

  • Coenzyme A, stearoyl-(1,N(6))-etheno-
  • Stearoyl-(1,N(6))-etheno-coa
  • Stearoyl-epsilon-coa

Systematic Name

  • 3H-Imidazo(2,1-i)purine, 3-(3-O-phosphono-5-O-(1,3,7-trihydroxy-6,6-dimethyl-8,12,17-trioxo-2,4-dioxa-16-thia-9,13-diaza-1,3-diphosphatetratriacont-1-yl)-beta-D-ribofuranosyl)-, P,P'-dioxide, (R)-

Registry Numbers

CAS Registry Number

  • 73945-37-6

System Generated Number

  • 0073945376

Structure Descriptors

InChI

1S/C41H70N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-32(50)69-25-23-42-31(49)20-21-44-39(53)36(52)41(2,3)27-62-68(59,60)65-67(57,58)61-26-30-35(64-66(54,55)56)34(51)40(63-30)48-29-45-33-37-43-22-24-47(37)28-46-38(33)48/h22,24,28-30,34-36,40,51-52H,4-21,23,25-27H2,1-3H3,(H,42,49)(H,44,53)(H,57,58)(H,59,60)(H2,54,55,56)

InChIKey

QVYSJHMIKDJAPR-UHFFFAOYSA-N

Smiles

n1cn(c2ncn3c(c12)ncc3)[C@@H]1[C@@H](O)[C@@H]([C@@H](O1)CO[P@@](O)(O[P@@](OCC(C)(C)[C@@H](C(NCCC(NCCSC(=O)CCCCCCCCCCCCCCCCC)=O)=O)O)(=O)O)=O)OP(=O)(O)O