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(Q76421568)
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Aurentiacin
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3'C-substituted chalcone
0 references
mass
298.120509056
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₁₈O₄
0 references
canonical SMILES
O=C(C=CC=1C=CC=CC1)C2=C(OC)C=C(OC)C(=C2O)C
0 references
isomeric SMILES
CC1=C(C(=C(C=C1OC)OC)C(=O)/C=C/C2=CC=CC=C2)O
0 references
found in taxon
northern bayberry
1 reference
stated in
Leaf Gland Flavonoids in Comptonia peregrina and Myrica pensylvanica (Myricaceae).
Identifiers
InChI
InChI=1S/C18H18O4/c1-12-15(21-2)11-16(22-3)17(18(12)20)14(19)10-9-13-7-5-4-6-8-13/h4-11,20H,1-3H3/b10-9+
0 references
InChIKey
KHJPPYCLBALJRR-MDZDMXLPSA-N
0 references
PubChem CID
11472044
1 reference
matched by identifier from
InChIKey
InChIKey
KHJPPYCLBALJRR-MDZDMXLPSA-N
ChEBI ID
229795
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C18H18O4/c1-12-15(21-2)11-16(22-3)17(18(12)20)14(19)10-9-13-7-5-4-6-8-13/h4-11,20H,1-3H3/b10-9+
UniChem compound ID
16243494
1 reference
stated in
UniChem
KNApSAcK ID
C00007043
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KHJPPYCLBALJRR-MDZDMXLPSA-N
LIPID MAPS ID
LMPK12120224
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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