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Plant-Associated Volatile Organic Compound (VOC) Database (PVD)

A database supporting research and application of VOCs produced by plants and plant-associated microbes

(E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-one

Metabolic Pathways

Structure

IUPAC Name

(E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-one

PubChem CID

638014

Synonymous Names

BETA-IONONE
79-77-6
14901-07-6
trans-beta-Ionone
(E)-beta-Ionone
4-(2,6,6-Trimethylcyclohex-1-en-1-yl)but-3-en-2-one
4-(2,6,6-Trimethyl-1-cyclohexenyl)-3-buten-2-one
(3E)-4-(2,6,6-trimethylcyclohex-1-en-1-yl)but-3-en-2-one
beta-Jonone
.beta.-Ionone
(E)-4-(2,6,6-Trimethylcyclohex-1-en-1-yl)but-3-en-2-one
beta-E-Ionone
beta-Cyclocitrylideneacetone
3-Buten-2-one, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (3E)-
4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-one
FEMA No. 2595
CCRIS 6249
NSC 402758
b-ionone
beta-Ionon
ss-Ionone
(E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-one
UNII-A7NRR1HLH6
A7NRR1HLH6
EINECS 238-969-9
Ionone, .beta.-
3-Buten-2-one, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-
CCRIS 4289
beta-Ionone (trans)
trans-.beta.-Ionone
DTXSID4021769
CHEBI:32325
(E)-.beta.-Ionone
IONONE, BETA
EINECS 201-224-3
EINECS 288-959-3
NSC-46137
9-apo-beta-caroten-9-one
NSC-402758
3-Buten-2-one, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (E)-
BRN 1909544
.beta.-Cyclocitrylideneacetone
AI3-25073
DTXCID901769
4-(2,6,6-Trimethylcyclohex-1-ene-1-yl)-but-3-ene-2-one
(E)-4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-one
HSDB 8269
.beta.-Ionene
EC 201-224-3
EC 238-969-9
2-07-00-00140 (Beilstein Handbook Reference)
NSC46137
4-(2,6,6-Trimethyl-1(or 2)-cyclohexen-1-yl)-3-buten-2-one
trans-4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-one
85949-43-5
CAS-79-77-6
WLN: L6UTJ A1U1V1 B1 F1 F1
4-(2,6-Trimethyl-1-cyclohexenyl)-3-buten-2-one
3-Buten-2-one,6,6-trimethyl-1-cyclohexen-1-yl)-
MFCD00001549
4-(2,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-one
4-(2,6-Trimethyl-1-cyclohexen-l-yl)-3-buten-2-one
DTXSID9025451
[E]-4-[2,6,6-trimethyl-1-cyclohexen-1-yl]-3-buten-2-one
4-[2,6,6-trimethyl-1(or 2)-cyclohexen-1-yl]-3-buten-2-one
beta ionone
beta -ionone
beta -E-ionone
Ionone, beta-
Nat. Beta Ionone
Trans-beta -ionone
(E)-beta -ionone
beta-Ionone, 96%
beta-Ionone, synthetic
BETA-IONONE [FCC]
(3E)-BETA-IONONE
5,7-Megastigmadien-9-one
.beta.-Ionone isomer # 1
.beta.-Ionone isomer # 2
SCHEMBL23953
.BETA.-IONONE [MI]
.BETA.-IONONE [FHFI]
US9144538, beta-Ionone
CHEMBL559945
beta-Ionone, analytical standard
DTXCID3027952
US9138393, ?-Ionone
FEMA 2595
BETA-CYCLOCITRYLIDENACETONE
3-BENZYLAMINO-PROPIONICACID
BDBM181139
Tox21_201454
Tox21_300709
Tox21_302862
BBL009828
LS-871
NSC402758
STK801279
beta-Ionone, natural, >=85%, FG
AKOS000121023
CS-W015800
HY-W015084
beta-Ionone, purum, >=95.0% (GC)
NCGC00248145-01
NCGC00248145-02
NCGC00256534-01
NCGC00257517-01
NCGC00259005-01
AM806748
AS-68699
VS-02204
beta-Ionone, natural (US), >=85%, FG
CAS-14901-07-6
EN300-18432
D70747
EN300-755077
F81525
beta-Ionone, predominantly trans, >=97%, FCC, FG
J-008542
W-104258
Q27114873
4-(2,6,6-Trimethyl-1-cyclohexen-l-yl)-3-buten-2-one
F0451-1336
(E)-4-(2,6,6-trimethyl-1-cyclohexenyl)-but-3-en-2-one
(E)-4-(2,6,6-trimethylcyclohex-1-enyl)but-3-en-2-one
4-(2,6,6-trimethyl-1-cyclohexene-1-yl)-3-buten-2-one
(3E)-4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-one
(E)-4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-3-buten-2-on
4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-(E)-3-Buten-2-one
(3E)-4-(2,6,6-trimethylcyclohex-1-en-1-yl) but-3-en-2-one
3-Buten-2-one, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (E)
(E) - 4 - (2,6,6 - trimethyl - 1 - cyclohexen - 1 - yl) - 3 - buten - 2 - one
4 - (2,6,6 - trimethylcyclohex - 1 - ene - 1 - yl) - but - 3 - ene - 2 - one

Formula

C13H20O

Molecular Weight

192.3

Chemical Class

Ketone, Sesquiterpenoid, Aliphatic, Prenol, Carbonyl, Enone, Organic oxide

Reference Link

Bergstrom, G., Birgersson, G., Groth, I., and Anders Nilsson, L. 1992. Floral fragrance disparity between three taxa of lady’s slipper Cypripedium calceolus (orchidaceae). Phytochemistry. 31:2315–2319.
Goff, S. A., and Klee, H. J. 2006. Plant volatile compounds: sensory cues for health and nutritional value? Science. 311:815–9.
Attaran, E., Rostás, M., and Zeier, J. 2008. Pseudomonas syringae elicits emission of the terpenoid (E,E)-4,8,12-trimethyl-1,3,7,11-tridecatetraene in Arabidopsis leaves via jasmonate signaling and expression of the terpene synthase TPS4. Mol Plant Micro

Plants/Microbial Species and Abiotic/Biotic Stimuli

Plant/Microbial Species	Abiotic/Biotic Stimuli
Arabidopsis thaliana (Thale cress, Mouse-ear cress)	Bacteria - Pseudomonas syringae
Lycopersicon esculentum (Tomato)	None
Cypripedium calceolus (Lady's slipper orchid)	None

Confirmed/Hypothesized Functions