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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

ce(22:4(7z,10z,13z,16z))  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C49H80O2

inchi

  • InChI=1S/C49H80O2/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/h11-12,14-15,17-18,20-21,30,39-40,42-46H,7-10,13,16,19,22-29,31-38H2,1-6H3/b12-11-,15-14-,18-17-,21-20-/t40-,42+,43+,44-,45+,46+,48+,49-/m1/s1

inchikey

  • ITGTXSFLBABXQA-BMURBKCOSA-N

mass

  • 701.160

monoisotopicmass

  • 700.61583

smiles

  • C(=C/C/C=C/C/C=C/CCCCCC(O[C@@H]1CC=2[C@@]([C@@]3([C@]([C@]4([C@@]([C@](CC4)([C@@](CCCC(C)C)(C)[H])[H])(CC3)C)[H])(CC2)[H])[H])(CC1)C)=O)/C/C=C/CCCCC

subset

  • 3_STAR

synonym EXACT

  • (3beta)-cholest-5-en-3-yl (7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:142698

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