[4-[(2E)-3,7-Dimethyl-5-oxo-2,6-octadien-1-yl]-2-formyl-3-hydroxy-5-methoxyphenyl]methyl (9Z,12Z)-9,12-octadecadienoate

CAS Registry Number®

137592-05-3

CAS Name

[4-[(2E)-3,7-Dimethyl-5-oxo-2,6-octadien-1-yl]-2-formyl-3-hydroxy-5-methoxyphenyl]methyl (9Z,12Z)-9,12-octadecadienoate

Molecular Formula

C37H54O6

Molecular Mass

594.82

Cite this Page

[4-[(2E)-3,7-Dimethyl-5-oxo-2,6-octadien-1-yl]-2-formyl-3-hydroxy-5-methoxyphenyl]methyl (9Z,12Z)-9,12-octadecadienoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=137592-05-3 (retrieved 2024-11-08) (CAS RN: 137592-05-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C37H54O6/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/h10-11,13-14,22,24,26-27,41H,6-9,12,15-21,23,25,28H2,1-5H3/b11-10-,14-13-,30-22+

InChIKey

InChIKey=SUAXEWQRYKSWIW-OFVWHMROSA-N

SMILES

C(OC(CCCCCCC/C=C\C/C=C\CCCCC)=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)CCCCCCCC=CCC=CCCCCC)CC=C(C)CC(=O)C=C(C)C

Other Names for this Substance

  • 9,12-Octadecadienoic acid (9Z,12Z)-, [4-[(2E)-3,7-dimethyl-5-oxo-2,6-octadien-1-yl]-2-formyl-3-hydroxy-5-methoxyphenyl]methyl ester
  • 9,12-Octadecadienoic acid (Z,Z)-, [4-(3,7-dimethyl-5-oxo-2,6-octadienyl)-2-formyl-3-hydroxy-5-methoxyphenyl]methyl ester, (E)-
  • 9,12-Octadecadienoic acid (9Z,12Z)-, [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 (9Z,12Z)-9,12-octadecadienoate
  • Hericenone E

Deleted or Replaced CAS Registry Numbers

1638096-92-0

CAS INSIGHTSTM
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