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Lysionotin
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
chemical formula
C₁₈H₁₆O₇
0 references
canonical SMILES
COc1ccc(-c2cc(=O)c3c(O)c(OC)c(O)c(OC)c3o2)cc1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C18H16O7/c1-22-10-6-4-9(5-7-10)12-8-11(19)13-14(20)17(23-2)15(21)18(24-3)16(13)25-12/h4-8,20-21H,1-3H3
0 references
InChIKey
KRFBMPVGAYGGJE-UHFFFAOYSA-N
1 reference
based on heuristic
inferred from InChI
CAS Registry Number
152743-19-6
0 references
PubChem CID
160921
1 reference
matched by identifier from
InChIKey
InChIKey
KRFBMPVGAYGGJE-UHFFFAOYSA-N
ChEBI ID
7545
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C18H16O7/c1-22-10-6-4-9(5-7-10)12-8-11(19)13-14(20)17(23-2)15(21)18(24-3)16(13)25-12/h4-8,20-21H,1-3H3
SureChEMBL ID
SCHEMBL2178589
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KRFBMPVGAYGGJE-UHFFFAOYSA-N
DSSTox substance ID
DTXSID40144174
1 reference
matched by identifier from
InChIKey
InChIKey
KRFBMPVGAYGGJE-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0255572
1 reference
matched by identifier from
InChIKey
InChIKey
KRFBMPVGAYGGJE-UHFFFAOYSA-N
KNApSAcK ID
C00001075
1 reference
matched by identifier from
InChIKey
InChIKey
KRFBMPVGAYGGJE-UHFFFAOYSA-N
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