Prehumulone

CAS Registry Number®

59122-94-0

CAS Name

Prehumulone

Molecular Formula

C22H32O5

Molecular Mass

376.49

Cite this Page

Prehumulone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=59122-94-0 (retrieved 2024-11-24) (CAS RN: 59122-94-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H32O5/c1-13(2)7-9-16-19(24)18(17(23)10-8-14(3)4)21(26)22(27,20(16)25)12-11-15(5)6/h7,11,14,24,26-27H,8-10,12H2,1-6H3

InChIKey

InChIKey=XZNPJHIDAGGFJJ-UHFFFAOYSA-N

SMILES

C(CCC(C)C)(=O)C1=C(O)C(CC=C(C)C)(O)C(=O)C(CC=C(C)C)=C1O

Canonical SMILES

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

Other Names for this Substance

  • 2,4-Cyclohexadien-1-one, 3,5,6-trihydroxy-2,6-bis(3-methyl-2-buten-1-yl)-4-(4-methyl-1-oxopentyl)-
  • 2,4-Cyclohexadien-1-one, 3,5,6-trihydroxy-2,6-bis(3-methyl-2-butenyl)-4-(4-methyl-1-oxopentyl)-
  • 3,5,6-Trihydroxy-2,6-bis(3-methyl-2-buten-1-yl)-4-(4-methyl-1-oxopentyl)-2,4-cyclohexadien-1-one
  • Prehumulone

CAS INSIGHTSTM
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