9-Octadecenoic acid (9Z)-, [4-[(2Z)-3,7-dimethyl-2,6-octadienyl]-2-formyl-3-hydroxy-5-methoxyphenyl]methyl ester

CAS Registry Number®

157207-55-1

CAS Name

9-Octadecenoic acid (9Z)-, [4-[(2Z)-3,7-dimethyl-2,6-octadienyl]-2-formyl-3-hydroxy-5-methoxyphenyl]methyl ester

Molecular Formula

C37H58O5

Molecular Mass

582.85

Cite this Page

9-Octadecenoic acid (9Z)-, [4-[(2Z)-3,7-dimethyl-2,6-octadienyl]-2-formyl-3-hydroxy-5-methoxyphenyl]methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=157207-55-1 (retrieved 2024-11-13) (CAS RN: 157207-55-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C37H58O5/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-36(39)42-29-32-27-35(41-5)33(37(40)34(32)28-38)26-25-31(4)23-21-22-30(2)3/h13-14,22,25,27-28,40H,6-12,15-21,23-24,26,29H2,1-5H3

InChIKey

InChIKey=UJSYMVCGDZCLIO-UHFFFAOYSA-N

SMILES

C(OC(CCCCCCCC=CCCCCCCCC)=O)C1=C(C=O)C(O)=C(CC=C(CCC=C(C)C)C)C(OC)=C1

Canonical SMILES

O=CC1=C(O)C(=C(OC)C=C1COC(=O)CCCCCCCC=CCCCCCCCC)CC=C(C)CCC=C(C)C

Other Names for this Substance

  • 9-Octadecenoic acid (9Z)-, [4-[(2Z)-3,7-dimethyl-2,6-octadienyl]-2-formyl-3-hydroxy-5-methoxyphenyl]methyl ester
  • 9-Octadecenoic acid (Z)-, [4-(3,7-dimethyl-2,6-octadienyl)-2-formyl-3-hydroxy-5-methoxyphenyl]methyl ester, (E)-
  • Hericene B
  • 9-Octadecenoic acid (9Z)-, [4-(3,7-dimethyl-2,6-octadienyl)-2-formyl-3-hydroxy-5-methoxyphenyl]methyl ester, (E)-

CAS INSIGHTSTM
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