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(Q105193064)
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English
isoglycyrol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2C-prenylcoumestan
0 references
mass
366.110338296
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₁₈O₆
0 references
canonical SMILES
O=C1OC=2C=C(OC)C3=C(OC(C)(C)CC3)C2C=4OC=5C=C(O)C=CC5C14
0 references
found in taxon
liquorice
1 reference
stated in
Revised structures of Glycyrol and Isoglycyrol, Constituents of the Root of Glycyrrhiza uralensis.
Glycyrrhiza uralensis
1 reference
stated in
Revised structures of Glycyrol and Isoglycyrol, Constituents of the Root of Glycyrrhiza uralensis.
Glycyrrhiza aspera
1 reference
stated in
Revised structures of Glycyrol and Isoglycyrol, Constituents of the Root of Glycyrrhiza uralensis.
Identifiers
InChI
InChI=1S/C21H18O6/c1-21(2)7-6-12-13(24-3)9-15-17(18(12)27-21)19-16(20(23)26-15)11-5-4-10(22)8-14(11)25-19/h4-5,8-9,22H,6-7H2,1-3H3
0 references
InChIKey
OJFZQSUOBVJAIP-UHFFFAOYSA-N
0 references
PubChem CID
5318570
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OJFZQSUOBVJAIP-UHFFFAOYSA-N
UniChem compound ID
32029935
1 reference
stated in
UniChem
KNApSAcK ID
C00009778
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OJFZQSUOBVJAIP-UHFFFAOYSA-N
LIPID MAPS ID
LMPK12090045
1 reference
InChIKey
OJFZQSUOBVJAIP-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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