Cholesteryl arachidonate

CAS Registry Number®

604-34-2
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CAS Name

Cholesteryl arachidonate

Molecular Formula

C47H76O2

Molecular Mass

673.11

Cite this Page

Cholesteryl arachidonate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=604-34-2 (retrieved 2024-05-03) (CAS RN: 604-34-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    19 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C47H76O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-45(48)49-40-32-34-46(5)39(36-40)28-29-41-43-31-30-42(38(4)26-24-25-37(2)3)47(43,6)35-33-44(41)46/h11-12,14-15,17-18,20-21,28,37-38,40-44H,7-10,13,16,19,22-27,29-36H2,1-6H3/b12-11-,15-14-,18-17-,21-20-/t38-,40+,41+,42-,43+,44+,46+,47-/m1/s1

InChIKey

InChIKey=IMXSFYNMSOULQS-BEDFLICRSA-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(CCC/C=C\C/C=C\C/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)CCCC=CCC=CCC=CCC=CCCCCC

Other Names for this Substance

  • Cholest-5-en-3-ol (3β)-, 3-[(5Z,8Z,11Z,14Z)-5,8,11,14-eicosatetraenoate]
  • Cholesterol, arachidonate
  • Cholest-5-en-3-ol (3β)-, 5,8,11,14-eicosatetraenoate, (all-Z)-
  • Cholest-5-en-3-ol (3β)-, (5Z,8Z,11Z,14Z)-5,8,11,14-eicosatetraenoate
  • Arachidonic acid, cholesteryl ester

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Deleted or Replaced CAS Registry Numbers

141099-59-4, 15066-74-7, 74125-97-6

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