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(Q72485477)
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English
7-Hydroxy-2-methyl-3-phenylchromen-4-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
isoflavonoid
0 references
mass
252.078644244
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₆H₁₂O₃
0 references
canonical SMILES
CC1=C(C(=O)C2=C(O1)C=C(C=C2)O)C3=CC=CC=C3
0 references
Identifiers
InChI
InChI=1S/C16H12O3/c1-10-15(11-5-3-2-4-6-11)16(18)13-8-7-12(17)9-14(13)19-10/h2-9,17H,1H3
0 references
InChIKey
BBCDTCKKROIGAB-UHFFFAOYSA-N
0 references
CAS Registry Number
2859-88-3
1 reference
InChIKey
BBCDTCKKROIGAB-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=2859-88-3
PubChem CID
5380976
0 references
ChEBI ID
174321
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C16H12O3/c1-10-15(11-5-3-2-4-6-11)16(18)13-8-7-12(17)9-14(13)19-10/h2-9,17H,1H3
UniChem compound ID
338531
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70182786
0 references
DSSTOX compound identifier
DTXCID10105277
0 references
NSC number
108340
0 references
Human Metabolome Database ID
HMDB0033979
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
BBCDTCKKROIGAB-UHFFFAOYSA-N
KNApSAcK ID
C00009379
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
BBCDTCKKROIGAB-UHFFFAOYSA-N
LIPID MAPS ID
LMPK12050001
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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