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(Q104970211)
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English
glabrol
group of stereoisomers with the chemical formula C₂₅H₂₈O₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
3',8C-diprenylflavanone
1 reference
inferred from
3',8C-diprenylflavanone
3',8C-substituted flavanone
1 reference
inferred from
3',8C-substituted flavanone
flavanone
0 references
mass
392.198759376
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₅H₂₈O₄
0 references
canonical SMILES
O=C1C2=CC=C(O)C(=C2OC(C3=CC=C(O)C(=C3)CC=C(C)C)C1)CC=C(C)C
0 references
found in taxon
Glycyrrhiza inflata
2 references
stated in
An isoflavan phytoalexin from leaves of Glycyrrhiza glabra
stated in
Liqcoumarin, a novel coumarin from Glycyrrhiza glabra
Sophora tonkinensis
1 reference
stated in
Flavonoids in roots of Sophora prostrata
liquorice
2 references
stated in
Liqcoumarin, a novel coumarin from Glycyrrhiza glabra
stated in
An isoflavan phytoalexin from leaves of Glycyrrhiza glabra
Euchresta horsfieldii
1 reference
stated in
Isoflavones from roots of Euchresta japonica
Sophora jaubertii
3 references
stated in
Six flavonostilbenes and a flavanone in roots of Sophora alopecuroides
stated in
Structures of two new flavanones fromVexibia alopecuroides
stated in
Flavonoids ofVexibia alopecuroides
Identifiers
InChI
InChI=1S/C25H28O4/c1-15(2)5-7-17-13-18(8-11-21(17)26)24-14-23(28)20-10-12-22(27)19(25(20)29-24)9-6-16(3)4/h5-6,8,10-13,24,26-27H,7,9,14H2,1-4H3
0 references
InChIKey
CUFAXDWQDQQKFF-UHFFFAOYSA-N
0 references
PubChem CID
480768
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CUFAXDWQDQQKFF-UHFFFAOYSA-N
ChEBI ID
175136
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C25H28O4/c1-15(2)5-7-17-13-18(8-11-21(17)26)24-14-23(28)20-10-12-22(27)19(25(20)29-24)9-6-16(3)4/h5-6,8,10-13,24,26-27H,7,9,14H2,1-4H3
SureChEMBL ID
SCHEMBL745275
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CUFAXDWQDQQKFF-UHFFFAOYSA-N
UniChem compound ID
30016484
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-RIKEN-PR309041
1 reference
InChIKey
CUFAXDWQDQQKFF-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
DSSTox substance ID
DTXSID50975274
1 reference
matched by identifier from
InChIKey
InChIKey
CUFAXDWQDQQKFF-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0029531
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CUFAXDWQDQQKFF-UHFFFAOYSA-N
LIPID MAPS ID
LMPK12140041
1 reference
InChIKey
CUFAXDWQDQQKFF-UHFFFAOYSA-N
stated in
LIPID MAPS
retrieved
17 April 2021
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
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