2,4-Decadienoic acid, (1aR,2S,5R,5aS,6S,8aS,9R,10aR)-4-[(acetyloxy)methyl]-1a,2,5,5a,6,9,10,10a-octahydro-5,5a-dihydroxy-1,1,7,9-tetramethyl-11-oxo-1H-2,8a-methanocyclopenta[a]cyclopropa[e]cyclodecen-6-yl ester, (2E,4Z)-

CAS Registry Number®

158850-76-1

CAS Name

2,4-Decadienoic acid, (1aR,2S,5R,5aS,6S,8aS,9R,10aR)-4-[(acetyloxy)methyl]-1a,2,5,5a,6,9,10,10a-octahydro-5,5a-dihydroxy-1,1,7,9-tetramethyl-11-oxo-1H-2,8a-methanocyclopenta[a]cyclopropa[e]cyclodecen-6-yl ester, (2E,4Z)-

Molecular Formula

C32H44O7

Molecular Mass

540.69

Cite this Page

2,4-Decadienoic acid, (1aR,2S,5R,5aS,6S,8aS,9R,10aR)-4-[(acetyloxy)methyl]-1a,2,5,5a,6,9,10,10a-octahydro-5,5a-dihydroxy-1,1,7,9-tetramethyl-11-oxo-1H-2,8a-methanocyclopenta[a]cyclopropa[e]cyclodecen-6-yl ester, (2E,4Z)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=158850-76-1 (retrieved 2024-11-10) (CAS RN: 158850-76-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C32H44O7/c1-7-8-9-10-11-12-13-14-25(34)39-29-19(2)17-31-20(3)15-24-26(30(24,5)6)23(28(31)36)16-22(18-38-21(4)33)27(35)32(29,31)37/h11-14,16-17,20,23-24,26-27,29,35,37H,7-10,15,18H2,1-6H3/b12-11-,14-13+/t20-,23+,24-,26+,27-,29+,31+,32+/m1/s1

InChIKey

InChIKey=SYXKKJDQNXPUSI-IFEMBOOLSA-N

SMILES

O[C@@]12[C@@]3(C(=O)[C@]([C@]4([C@@](C[C@H]3C)(C4(C)C)[H])[H])(C=C(COC(C)=O)[C@H]1O)[H])C=C(C)[C@@H]2OC(/C=C/C=C\CCCCC)=O

Canonical SMILES

O=C(OC1C(=CC23C(=O)C(C=C(COC(=O)C)C(O)C12O)C4C(CC3C)C4(C)C)C)C=CC=CCCCCC

Other Names for this Substance

  • 2,4-Decadienoic acid, (1aR,2S,5R,5aS,6S,8aS,9R,10aR)-4-[(acetyloxy)methyl]-1a,2,5,5a,6,9,10,10a-octahydro-5,5a-dihydroxy-1,1,7,9-tetramethyl-11-oxo-1H-2,8a-methanocyclopenta[a]cyclopropa[e]cyclodecen-6-yl ester, (2E,4Z)-
  • 2,4-Decadienoic acid, 4-[(acetyloxy)methyl]-1a,2,5,5a,6,9,10,10a-octahydro-5,5a-dihydroxy-1,1,7,9-tetramethyl-11-oxo-1H-2,8a-methanocyclopenta[a]cyclopropa[e]cyclodecen-6-yl ester, [1aR-[1aα,2α,5β,5aβ,6β(2E,4Z),8aα,9α,10aα]]-
  • 1H-2,8a-Methanocyclopenta[a]cyclopropa[e]cyclodecene, 2,4-decadienoic acid deriv.
  • 3-O-(2E,4Z-Decadienoyl)-20-O-acetylingenol
  • 20-O-Acetylingenol 3-O-(2′E,4′Z)-decadienoate

CAS INSIGHTSTM
Abstract Background of Blurry Golden Particles