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(Q104169025)
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English
3-butylidene-4,5-dihydro-2-benzofuran-1-one
chemical compound
(E/Z)-ligustilide
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
190.099379688
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₁₄O₂
0 references
canonical SMILES
O=C1OC(=CCCC)C2=C1C=CCC2
0 references
found in taxon
Ligusticum chuanxiong
2 references
stated in
(Z)-3-butylidenephthalide from Ligusticum porteri , an α-glucosidase inhibitor.
stated in
Post-harvest alteration of the main chemical ingredients in Ligusticum chuanxiong Hort. (Rhizoma Chuanxiong)
Conioselinum anthriscoides
2 references
stated in
(Z)-3-butylidenephthalide from Ligusticum porteri , an α-glucosidase inhibitor.
stated in
Post-harvest alteration of the main chemical ingredients in Ligusticum chuanxiong Hort. (Rhizoma Chuanxiong)
Angelica sinensis
5 references
stated in
Cytotoxic constituents from angelicae sinensis radix
stated in
Serotonergic activity-guided phytochemical investigation of the roots of Angelica sinensis
stated in
Identification and comparative quantification of bio-active phthalides in essential oils from si-wu-tang, fo-shou-san, radix angelica and rhizoma chuanxiong.
stated in
Identification and quantification of 13 components in Angelica sinensis (Danggui) by gas chromatography–mass spectrometry coupled with pressurized liquid extraction
stated in
GABAergic phthalide dimers fromAngelica sinensis (Oliv.) Diels
Ligusticum porteri
6 references
stated in
(Z)-3-butylidenephthalide from Ligusticum porteri , an α-glucosidase inhibitor.
stated in
(Z)-3-butylidenephthalide from Ligusticum porteri , an α-glucosidase inhibitor.
stated in
Secondary Metabolites from the Roots of Ligusticum porteri (Umbelliferae). X-Ray Structure of Z-6.6',7.3a'-Diligustilide
stated in
(1)H and DOSY NMR spectroscopy analysis of Ligusticum porteri rhizome extracts
stated in
Phthalides and other constituents from Ligusticum porteri; sedative and spasmolytic activities of some natural products and derivatives
stated in
Post-harvest alteration of the main chemical ingredients in Ligusticum chuanxiong Hort. (Rhizoma Chuanxiong)
Angelica acutiloba
3 references
stated in
Insecticidal effect of phthalides and furanocoumarins from Angelica acutiloba against Drosophila melanogaster
stated in
Identification and quantification of 13 components in Angelica sinensis (Danggui) by gas chromatography–mass spectrometry coupled with pressurized liquid extraction
stated in
Serotonergic activity-guided phytochemical investigation of the roots of Angelica sinensis
Angelica glauca
1 reference
stated in
Angeolide, a Novel Lactone fromAngelica glauca
Levisticum officinale
1 reference
stated in
Neue Inhaltsstoffe vonLevisticum officinale Koch (Liebstöckel)
Angelica gigas
2 references
stated in
Identification and quantification of 13 components in Angelica sinensis (Danggui) by gas chromatography–mass spectrometry coupled with pressurized liquid extraction
stated in
Serotonergic activity-guided phytochemical investigation of the roots of Angelica sinensis
Ligusticum striatum
2 references
stated in
Post-harvest alteration of the main chemical ingredients in Ligusticum chuanxiong Hort. (Rhizoma Chuanxiong)
stated in
(Z)-3-butylidenephthalide from Ligusticum porteri , an α-glucosidase inhibitor.
celery
4 references
stated in
Phytochemical and biological characterization of Italian "sedano bianco di Sperlonga" Protected Geographical Indication celery ecotype: A multimethodological approach
stated in
Effect of nitrogen fertilizers on celery volatiles
stated in
Free and glycosidically bound volatile compounds in fresh celery (Apium graveolens L.)
stated in
Aromatic Volatile Composition of Celery and Celeriac Cultivars
Identifiers
InChI
InChI=1S/C12H14O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h5,7-8H,2-4,6H2,1H3
0 references
InChIKey
IQVQXVFMNOFTMU-UHFFFAOYSA-N
0 references
CAS Registry Number
4431-01-0
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
529865
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IQVQXVFMNOFTMU-UHFFFAOYSA-N
UniChem compound ID
43331724
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40863398
1 reference
matched by identifier from
InChIKey
InChIKey
IQVQXVFMNOFTMU-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0259970
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IQVQXVFMNOFTMU-UHFFFAOYSA-N
KNApSAcK ID
C00063078
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IQVQXVFMNOFTMU-UHFFFAOYSA-N
Probes And Drugs ID
PD087574
0 references
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