9,12-Octadecadienoic acid (9Z,12Z)-, [8-formyl-3,4-dihydro-5-methoxy-2-methyl-2-(4-methyl-2-oxo-3-pentenyl)-2H-1-benzopyran-7-yl]methyl ester

CAS Registry Number®

141973-37-7

CAS Name

9,12-Octadecadienoic acid (9Z,12Z)-, [8-formyl-3,4-dihydro-5-methoxy-2-methyl-2-(4-methyl-2-oxo-3-pentenyl)-2H-1-benzopyran-7-yl]methyl ester

Molecular Formula

C37H54O6

Molecular Mass

594.82

Cite this Page

9,12-Octadecadienoic acid (9Z,12Z)-, [8-formyl-3,4-dihydro-5-methoxy-2-methyl-2-(4-methyl-2-oxo-3-pentenyl)-2H-1-benzopyran-7-yl]methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=141973-37-7 (retrieved 2024-11-27) (CAS RN: 141973-37-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C37H54O6/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-35(40)42-28-30-25-34(41-5)32-22-23-37(4,26-31(39)24-29(2)3)43-36(32)33(30)27-38/h10-11,13-14,24-25,27H,6-9,12,15-23,26,28H2,1-5H3

InChIKey

InChIKey=WQODVCURNLADTH-UHFFFAOYSA-N

SMILES

C(=O)C1=C2C(=C(OC)C=C1COC(CCCCCCCC=CCC=CCCCCC)=O)CCC(CC(C=C(C)C)=O)(C)O2

Canonical SMILES

O=CC1=C2OC(C)(CC(=O)C=C(C)C)CCC2=C(OC)C=C1COC(=O)CCCCCCCC=CCC=CCCCCC

Other Names for this Substance

  • 9,12-Octadecadienoic acid (9Z,12Z)-, [8-formyl-3,4-dihydro-5-methoxy-2-methyl-2-(4-methyl-2-oxo-3-pentenyl)-2H-1-benzopyran-7-yl]methyl ester
  • 9,12-Octadecadienoic acid (Z,Z)-, [8-formyl-3,4-dihydro-5-methoxy-2-methyl-2-(4-methyl-2-oxo-3-pentenyl)-2H-1-benzopyran-7-yl]methyl ester
  • Hericenone H

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