Campesteryl ferulate

CAS Registry Number®

20972-07-0
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CAS Name

Campesteryl ferulate

Molecular Formula

C38H56O4

Molecular Mass

576.85

Cite this Page

Campesteryl ferulate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=20972-07-0 (retrieved 2024-04-26) (CAS RN: 20972-07-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C38H56O4/c1-24(2)25(3)8-9-26(4)31-14-15-32-30-13-12-28-23-29(18-20-37(28,5)33(30)19-21-38(31,32)6)42-36(40)17-11-27-10-16-34(39)35(22-27)41-7/h10-12,16-17,22,24-26,29-33,39H,8-9,13-15,18-21,23H2,1-7H3/t25-,26-,29+,30+,31-,32+,33+,37+,38-/m1/s1

InChIKey

InChIKey=SWIWTAJTJOYCTB-SOZMWJGCSA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@]([C@@H](CC[C@H](C(C)C)C)C)(CC4)[H])[H])(CC=C1C[C@@H](OC(C=CC5=CC(OC)=C(O)C=C5)=O)CC2)[H])[H]

Canonical SMILES

O=C(OC1CC2=CCC3C(CCC4(C)C(CCC34)C(C)CCC(C)C(C)C)C2(C)CC1)C=CC5=CC=C(O)C(OC)=C5

Other Names for this Substance

  • Ergost-5-en-3-ol, 3-(4-hydroxy-3-methoxyphenyl)-2-propenoate, (3β,24R)-
  • Ergost-5-en-3β-ol, 4-hydroxy-3-methoxycinnamate, (24R)-
  • Cinnamic acid, 4-hydroxy-3-methoxy-, ergost-5-en-3β-yl ester, (24R)-
  • Campesterol ferulate
  • Campesterol ferulic acid ester

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Deleted or Replaced CAS Registry Numbers

95777-66-5

CAS INSIGHTSTM
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