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(Q105325263)
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English
5,7-dimethoxy-2-(4-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-ol
group of stereoisomers with the chemical formula C₁₈H₂₀O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
flavan
1 reference
inferred from
flavan
mass
316.1310737399999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₈H₂₀O₅
0 references
canonical SMILES
OC1C=2C(OC)=CC(OC)=CC2OC(C3=CC=C(OC)C=C3)C1
0 references
Identifiers
InChI
InChI=1S/C18H20O5/c1-20-12-6-4-11(5-7-12)15-10-14(19)18-16(22-3)8-13(21-2)9-17(18)23-15/h4-9,14-15,19H,10H2,1-3H3
0 references
InChIKey
XCMICCXLNOOUBF-UHFFFAOYSA-N
0 references
PubChem CID
584467
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XCMICCXLNOOUBF-UHFFFAOYSA-N
ChEBI ID
187260
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C18H20O5/c1-20-12-6-4-11(5-7-12)15-10-14(19)18-16(22-3)8-13(21-2)9-17(18)23-15/h4-9,14-15,19H,10H2,1-3H3
UniChem compound ID
580622
1 reference
stated in
UniChem
LIPID MAPS ID
LMPK12020173
1 reference
InChIKey
XCMICCXLNOOUBF-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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