Cholesteryl linoleate

CAS Registry Number®

604-33-1
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CAS Name

Cholesteryl linoleate

Molecular Formula

C45H76O2

Molecular Mass

649.08

Cite this Page

Cholesteryl linoleate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=604-33-1 (retrieved 2024-05-01) (CAS RN: 604-33-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    41-42.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C45H76O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-43(46)47-38-30-32-44(5)37(34-38)26-27-39-41-29-28-40(36(4)24-22-23-35(2)3)45(41,6)33-31-42(39)44/h11-12,14-15,26,35-36,38-42H,7-10,13,16-25,27-34H2,1-6H3/b12-11-,15-14-/t36-,38+,39+,40-,41+,42+,44+,45-/m1/s1

InChIKey

InChIKey=NAACPBBQTFFYQB-LJAITQKLSA-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(CCCCCCC/C=C\C/C=C\CCCCC)=O)CC2)[H])[H]

Canonical SMILES

O=C(OC1CC2=CCC3C(CCC4(C)C(CCC34)C(C)CCCC(C)C)C2(C)CC1)CCCCCCCC=CCC=CCCCCC

Other Names for this Substance

  • Cholest-5-en-3-ol (3β)-, 3-[(9Z,12Z)-9,12-octadecadienoate]
  • Cholesterol, linoleate
  • Linoleic acid, cholesteryl ester
  • Cholest-5-en-3-ol (3β)-, 9,12-octadecadienoate, (Z,Z)-
  • Cholest-5-en-3-ol (3β)-, (9Z,12Z)-9,12-octadecadienoate

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Deleted or Replaced CAS Registry Numbers

100339-48-8, 126346-09-6, 55102-87-9

CAS INSIGHTSTM
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