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Concept information

... > organooxygen compound > ester > steroid ester > sterol ester > cholesteryl ester > ce(17:1) > cholesteryl (9z)-heptadecenoate

Preferred term

cholesteryl (9z)-heptadecenoate  

Type

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

Broader concept

charge

  • 0

formula

  • C44H76O2

has_functional_parent

inchi

  • InChI=1S/C44H76O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-42(45)46-37-29-31-43(5)36(33-37)25-26-38-40-28-27-39(35(4)23-21-22-34(2)3)44(40,6)32-30-41(38)43/h13-14,25,34-35,37-41H,7-12,15-24,26-33H2,1-6H3/b14-13-/t35-,37+,38+,39-,40+,41+,43+,44-/m1/s1

inchikey

  • RLMIGWIAENJHMP-RJRTUNKTSA-N

mass

  • 637.07300

monoisotopicmass

  • 636.58453

smiles

  • CCCCCCC/C=C/CCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CCCC(C)C

subset

  • 3_STAR

synonym EXACT

  • (3beta)-cholest-5-en-3-yl (9Z)-heptadec-9-enoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:84329

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