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(Q83021682)
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English
Gancaonin B
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
isoflavonoid
0 references
6C-substituted isoflavone
0 references
6C-prenylisoflavone
0 references
mass
368.12598836
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₀O₆
0 references
canonical SMILES
O=C1C(=COC2=CC(O)=C(C(O)=C12)CC=C(C)C)C=3C=CC(OC)=C(O)C3
0 references
found in taxon
Glycyrrhiza uralensis
2 references
stated in
Four New Prenylated Flavonoids from Aerial Parts of Glycyrrhiza uralensis
stated in
Four New Prenylated Flavonoids from Aerial Parts of Glycyrrhiza uralensis
Dermatophyllum secundiflorum
2 references
stated in
Isoflavonoids in roots of Sophora secundiflora
stated in
Isoflavonoids in roots of Sophora secundiflora
Identifiers
InChI
InChI=1S/C21H20O6/c1-11(2)4-6-13-15(22)9-18-19(20(13)24)21(25)14(10-27-18)12-5-7-17(26-3)16(23)8-12/h4-5,7-10,22-24H,6H2,1-3H3
0 references
InChIKey
YQEPOQVRUDADPH-UHFFFAOYSA-N
0 references
CAS Registry Number
124596-86-7
1 reference
stated in
CAS Common Chemistry
retrieved
6 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=124596-86-7
InChIKey
YQEPOQVRUDADPH-UHFFFAOYSA-N
PubChem CID
5317479
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
ChEBI ID
175730
mapping relation type
exact match
1 reference
stated in
ChEBI release 2022-06-13
SureChEMBL ID
SCHEMBL1170939
1 reference
based on heuristic
inferred from InChIKey
UniChem compound ID
32008072
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60154437
0 references
DSSTOX compound identifier
DTXCID4076928
0 references
Human Metabolome Database ID
HMDB0038488
1 reference
based on heuristic
inferred from InChIKey
KNApSAcK ID
C00009891
1 reference
based on heuristic
inferred from InChIKey
LIPID MAPS ID
LMPK12050262
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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