Cholesteryl nervonate

CAS Registry Number®

60758-73-8
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CAS Name

Cholesteryl nervonate

Molecular Formula

C51H90O2

Molecular Mass

735.26

Cite this Page

Cholesteryl nervonate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=60758-73-8 (retrieved 2024-07-25) (CAS RN: 60758-73-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C51H90O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-31-49(52)53-44-36-38-50(5)43(40-44)32-33-45-47-35-34-46(42(4)30-28-29-41(2)3)51(47,6)39-37-48(45)50/h14-15,32,41-42,44-48H,7-13,16-31,33-40H2,1-6H3/b15-14-/t42-,44+,45+,46-,47+,48+,50+,51-/m1/s1

InChIKey

InChIKey=PUKCXSHDVCMMAN-FYGHJIOESA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@]([C@@H](CCCC(C)C)C)(CC4)[H])[H])(CC=C1C[C@@H](OC(CCCCCCCCCCCCC/C=C\CCCCCCCC)=O)CC2)[H])[H]

Canonical SMILES

O=C(OC1CC2=CCC3C(CCC4(C)C(CCC34)C(C)CCCC(C)C)C2(C)CC1)CCCCCCCCCCCCCC=CCCCCCCCC

Other Names for this Substance

  • Cholest-5-en-3-ol (3β)-, 3-[(15Z)-15-tetracosenoate]
  • Cholest-5-en-3-ol (3β)-, (15Z)-15-tetracosenoate
  • Cholesteryl nervonate
  • Cholesteryl cis-15-tetracosenoate