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

CAS Registry Number®

157207-54-0
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CAS Name

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

Molecular Formula

C35H56O5

Molecular Mass

556.82

Cite this Page

[4-[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]-2-formyl-3-hydroxy-5-methoxyphenyl]methyl hexadecanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=157207-54-0 (retrieved 2024-05-18) (CAS RN: 157207-54-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C35H56O5/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-22-34(37)40-27-30-25-33(39-5)31(35(38)32(30)26-36)24-23-29(4)21-19-20-28(2)3/h20,23,25-26,38H,6-19,21-22,24,27H2,1-5H3/b29-23+

InChIKey

InChIKey=PLUINHYLFTYIKB-BYNJWEBRSA-N

SMILES

C(OC(CCCCCCCCCCCCCCC)=O)C1=C(C=O)C(O)=C(C/C=C(/CCC=C(C)C)\C)C(OC)=C1

Canonical SMILES

O=CC1=C(O)C(=C(OC)C=C1COC(=O)CCCCCCCCCCCCCCC)CC=C(C)CCC=C(C)C

Other Names for this Substance

  • Hexadecanoic acid, [4-[(2E)-3,7-dimethyl-2,6-octadien-1-yl]-2-formyl-3-hydroxy-5-methoxyphenyl]methyl ester
  • Hexadecanoic acid, [4-(3,7-dimethyl-2,6-octadienyl)-2-formyl-3-hydroxy-5-methoxyphenyl]methyl ester, (E)-
  • Hexadecanoic acid, [4-[(2E)-3,7-dimethyl-2,6-octadienyl]-2-formyl-3-hydroxy-5-methoxyphenyl]methyl ester
  • [4-[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]-2-formyl-3-hydroxy-5-methoxyphenyl]methyl hexadecanoate
  • Hericene A

Deleted or Replaced CAS Registry Numbers

1638096-89-5

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