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(Q104969017)
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English
agestricin D
group of stereoisomers with the chemical formula C₁₈H₁₈O₇
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Statements
instance of
group of stereoisomers
0 references
subclass of
flavanone
1 reference
inferred from
flavanone
mass
346.105252916
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₁₈O₇
0 references
canonical SMILES
O=C1C=2C(OC(C3=CC=C(O)C(OC)=C3)C1)=CC(OC)=C(O)C2OC
0 references
found in taxon
Ageratum corymbosum
1 reference
stated in
Highly oxygenated flavonoids from Ageratum corymbosum
Identifiers
InChI
InChI=1S/C18H18O7/c1-22-13-6-9(4-5-10(13)19)12-7-11(20)16-14(25-12)8-15(23-2)17(21)18(16)24-3/h4-6,8,12,19,21H,7H2,1-3H3
0 references
InChIKey
CRZFXGCWJNFUCY-UHFFFAOYSA-N
0 references
PubChem CID
21721836
2 references
stated in
PubChem
retrieved
2 January 2023
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CRZFXGCWJNFUCY-UHFFFAOYSA-N
ChEBI ID
196387
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C18H18O7/c1-22-13-6-9(4-5-10(13)19)12-7-11(20)16-14(25-12)8-15(23-2)17(21)18(16)24-3/h4-6,8,12,19,21H,7H2,1-3H3
UniChem compound ID
66017046
1 reference
stated in
UniChem
LIPID MAPS ID
LMPK12140627
1 reference
InChIKey
CRZFXGCWJNFUCY-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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