[4-[(2E)-3,7-Dimethyl-5-oxo-2,6-octadien-1-yl]-2-formyl-3-hydroxy-5-methoxyphenyl]methyl octadecanoate

CAS Registry Number®

137592-04-2
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CAS Name

[4-[(2E)-3,7-Dimethyl-5-oxo-2,6-octadien-1-yl]-2-formyl-3-hydroxy-5-methoxyphenyl]methyl octadecanoate

Molecular Formula

C37H58O6

Molecular Mass

598.85

Cite this Page

[4-[(2E)-3,7-Dimethyl-5-oxo-2,6-octadien-1-yl]-2-formyl-3-hydroxy-5-methoxyphenyl]methyl octadecanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=137592-04-2 (retrieved 2024-05-17) (CAS RN: 137592-04-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C37H58O6/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-36(40)43-28-31-26-35(42-5)33(37(41)34(31)27-38)23-22-30(4)25-32(39)24-29(2)3/h22,24,26-27,41H,6-21,23,25,28H2,1-5H3/b30-22+

InChIKey

InChIKey=ZTJZNRQMSBGEOJ-JBASAIQMSA-N

SMILES

C(OC(CCCCCCCCCCCCCCCCC)=O)C1=C(C=O)C(O)=C(C/C=C(/CC(C=C(C)C)=O)\C)C(OC)=C1

Canonical SMILES

O=CC1=C(O)C(=C(OC)C=C1COC(=O)CCCCCCCCCCCCCCCCC)CC=C(C)CC(=O)C=C(C)C

Other Names for this Substance

  • Octadecanoic acid, [4-[(2E)-3,7-dimethyl-5-oxo-2,6-octadien-1-yl]-2-formyl-3-hydroxy-5-methoxyphenyl]methyl ester
  • Octadecanoic acid, [4-(3,7-dimethyl-5-oxo-2,6-octadienyl)-2-formyl-3-hydroxy-5-methoxyphenyl]methyl ester, (E)-
  • Octadecanoic acid, [4-[(2E)-3,7-dimethyl-5-oxo-2,6-octadienyl]-2-formyl-3-hydroxy-5-methoxyphenyl]methyl ester
  • [4-[(2E)-3,7-Dimethyl-5-oxo-2,6-octadien-1-yl]-2-formyl-3-hydroxy-5-methoxyphenyl]methyl octadecanoate
  • Hericenone D

Deleted or Replaced CAS Registry Numbers

1638096-93-1

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