Cholesteryl nervonate
CAS Registry Number®
60758-73-8
CAS Name
Cholesteryl nervonateMolecular Formula
C51H90O2Molecular Mass
735.26Cite this Page
Cholesteryl nervonate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=60758-73-8 (retrieved ) (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