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(Q82899089)
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Gancaonin E
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
flavanone
0 references
3',8C-substituted flavanone
0 references
3',8C-diprenylflavanone
0 references
mass
424.188588616
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₅H₂₈O₆
0 references
canonical SMILES
O=C1C2=C(O)C=C(O)C(=C2OC(C3=CC(O)=C(O)C(=C3)CC=C(C)C)C1)CC=C(C)C
0 references
found in taxon
Glycyrrhiza inflata
1 reference
stated in
Four New Prenylated Flavonoids from Aerial Parts of Glycyrrhiza uralensis
Identifiers
InChI
InChI=1S/C25H28O6/c1-13(2)5-7-15-9-16(10-21(29)24(15)30)22-12-20(28)23-19(27)11-18(26)17(25(23)31-22)8-6-14(3)4/h5-6,9-11,22,26-27,29-30H,7-8,12H2,1-4H3
0 references
InChIKey
HCBKENVWCDLQOA-UHFFFAOYSA-N
0 references
CAS Registry Number
124596-89-0
0 references
PubChem CID
480770
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HCBKENVWCDLQOA-UHFFFAOYSA-N
ChEBI ID
175410
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C25H28O6/c1-13(2)5-7-15-9-16(10-21(29)24(15)30)22-12-20(28)23-19(27)11-18(26)17(25(23)31-22)8-6-14(3)4/h5-6,9-11,22,26-27,29-30H,7-8,12H2,1-4H3
UniChem compound ID
31996068
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-RIKEN-PR309043
1 reference
InChIKey
HCBKENVWCDLQOA-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR310771
1 reference
InChIKey
HCBKENVWCDLQOA-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
DTXSID10924869
1 reference
matched by identifier from
InChIKey
InChIKey
HCBKENVWCDLQOA-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID601353701
0 references
Human Metabolome Database ID
HMDB0038868
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HCBKENVWCDLQOA-UHFFFAOYSA-N
LIPID MAPS ID
LMPK12140402
1 reference
stated in
LIPID MAPS
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
retrieved
30 June 2018
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