Colupulone

CAS Registry Number®

468-27-9

CAS Name

Colupulone

Molecular Formula

C25H36O4

Molecular Mass

400.55

Cite this Page

Colupulone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=468-27-9 (retrieved 2025-01-03) (CAS RN: 468-27-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    94 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C25H36O4/c1-15(2)9-10-19-22(27)20(21(26)18(7)8)24(29)25(23(19)28,13-11-16(3)4)14-12-17(5)6/h9,11-12,18,27,29H,10,13-14H2,1-8H3

InChIKey

InChIKey=GEXOPZHAKQAGLU-UHFFFAOYSA-N

SMILES

C(C=C(C)C)C1(CC=C(C)C)C(O)=C(C(C(C)C)=O)C(O)=C(CC=C(C)C)C1=O

Canonical SMILES

O=C(C=1C(O)=C(C(=O)C(C1O)(CC=C(C)C)CC=C(C)C)CC=C(C)C)C(C)C

Other Names for this Substance

  • 2,4-Cyclohexadien-1-one, 3,5-dihydroxy-2,6,6-tris(3-methyl-2-buten-1-yl)-4-(2-methyl-1-oxopropyl)-
  • 2,4-Cyclohexadien-1-one, 3,5-dihydroxy-4-isobutyryl-2,6,6-tris(3-methyl-2-butenyl)-
  • 2,4-Cyclohexadien-1-one, 3,5-dihydroxy-2,6,6-tris(3-methyl-2-butenyl)-4-(2-methyl-1-oxopropyl)-
  • 3,5-Dihydroxy-2,6,6-tris(3-methyl-2-buten-1-yl)-4-(2-methyl-1-oxopropyl)-2,4-cyclohexadien-1-one
  • Colupulone

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