Cholesteryl oleyl carbonate

CAS Registry Number®

17110-51-9
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CAS Name

Cholesteryl oleyl carbonate

Molecular Formula

C46H80O3

Molecular Mass

681.13

Cite this Page

Cholesteryl oleyl carbonate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=17110-51-9 (retrieved 2024-04-25) (CAS RN: 17110-51-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    20 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C46H80O3/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-34-48-44(47)49-39-30-32-45(5)38(35-39)26-27-40-42-29-28-41(37(4)25-23-24-36(2)3)46(42,6)33-31-43(40)45/h14-15,26,36-37,39-43H,7-13,16-25,27-35H2,1-6H3/b15-14-/t37-,39+,40+,41-,42+,43+,45+,46-/m1/s1

InChIKey

InChIKey=XMPIMLRYNVGZIA-TZOMHRFMSA-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(OCCCCCCCC/C=C\CCCCCCCC)=O)CC2)[H])[H]

Canonical SMILES

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

Other Names for this Substance

  • Cholest-5-en-3-ol (3β)-, 3-[(9Z)-9-octadecen-1-yl carbonate]
  • Cholesterol, 9-octadecenyl carbonate, (Z)-
  • Cholest-5-en-3-ol (3β)-, 9-octadecenyl carbonate, (Z)-
  • Cholest-5-en-3-ol (3β)-, (9Z)-9-octadecenyl carbonate
  • 9-Octadecen-1-ol, cholesteryl carbonate, (Z)-

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Deleted or Replaced CAS Registry Numbers

76202-42-1, 1638490-14-8

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