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Substance Name: Cholest-5-en-3-ol (3beta)-, 3-(13Z)-13-docosenoate
RN: 24516-39-0
InChIKey: SQHUGNAFKZZXOT-PFONDFGASA-N

Molecular Formula

  • C49-H86-O2

Molecular Weight

  • 707.216
 
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Names and Synonyms

Synonym

  • EINECS 246-292-5

Systematic Names

  • Cholest-5-en-3-ol (3beta)-, (13Z)-13-docosenoate
  • Cholest-5-en-3-ol (3beta)-, 3-(13Z)-13-docosenoate
  • Cholest-5-en-3beta-yl (Z)-13-docosenoate

Registry Numbers

CAS Registry Number

  • 24516-39-0

System Generated Number

  • 0024516390

Structure Descriptors

InChI

1S/C49H86O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-29-47(50)51-42-34-36-48(5)41(38-42)30-31-43-45-33-32-44(40(4)28-26-27-39(2)3)49(45,6)37-35-46(43)48/h14-15,30,39-40,42-46H,7-13,16-29,31-38H2,1-6H3/b15-14-

InChIKey

SQHUGNAFKZZXOT-PFONDFGASA-N

Smiles

C(\CCCCCCCC)=C/CCCCCCCCCCCC(O[C@@H]1CC2=CC[C@@H]3[C@@H]4CC[C@@H]([C@@]4(CC[C@@H]3[C@@]2(CC1)C)C)[C@@H](CCCC(C)C)C)=O