2-Benzoyl-4-[(2E)-3,7-dimethyl-2,6-octadien-1-yl]-3,5-dihydroxy-4,6-bis(3-methyl-2-buten-1-yl)-2,5-cyclohexadien-1-one

CAS Registry Number®

81827-55-6

CAS Name

2-Benzoyl-4-[(2E)-3,7-dimethyl-2,6-octadien-1-yl]-3,5-dihydroxy-4,6-bis(3-methyl-2-buten-1-yl)-2,5-cyclohexadien-1-one

Molecular Formula

C33H42O4

Molecular Mass

502.68

Cite this Page

2-Benzoyl-4-[(2E)-3,7-dimethyl-2,6-octadien-1-yl]-3,5-dihydroxy-4,6-bis(3-methyl-2-buten-1-yl)-2,5-cyclohexadien-1-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=81827-55-6 (retrieved 2024-11-13) (CAS RN: 81827-55-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C33H42O4/c1-22(2)12-11-13-25(7)19-21-33(20-18-24(5)6)31(36)27(17-16-23(3)4)30(35)28(32(33)37)29(34)26-14-9-8-10-15-26/h8-10,12,14-16,18-19,36-37H,11,13,17,20-21H2,1-7H3/b25-19+

InChIKey

InChIKey=FFIYTQGORMJUEB-NCELDCMTSA-N

SMILES

C(/C=C(/CCC=C(C)C)\C)C1(CC=C(C)C)C(O)=C(C(=O)C2=CC=CC=C2)C(=O)C(CC=C(C)C)=C1O

Canonical SMILES

O=C(C=1C=CC=CC1)C=2C(=O)C(=C(O)C(C2O)(CC=C(C)C)CC=C(C)CCC=C(C)C)CC=C(C)C

Other Names for this Substance

  • 2,5-Cyclohexadien-1-one, 2-benzoyl-4-[(2E)-3,7-dimethyl-2,6-octadien-1-yl]-3,5-dihydroxy-4,6-bis(3-methyl-2-buten-1-yl)-
  • 2,5-Cyclohexadien-1-one, 2-benzoyl-4-[(2E)-3,7-dimethyl-2,6-octadienyl]-3,5-dihydroxy-4,6-bis(3-methyl-2-butenyl)-
  • 2-Benzoyl-4-[(2E)-3,7-dimethyl-2,6-octadien-1-yl]-3,5-dihydroxy-4,6-bis(3-methyl-2-buten-1-yl)-2,5-cyclohexadien-1-one
  • Kolanone

CAS INSIGHTSTM
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