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(Q82902596)
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English
2-Hydroxy-1-(4-hydroxyphenyl)-5-methylhexan-3-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
222.125594436
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₈O₃
0 references
canonical SMILES
O=C(CC(C)C)C(O)CC1=CC=C(O)C=C1
0 references
found in taxon
Bacillus cereus
1 reference
stated in
Sattabacins and Sattazolins: New Biologically Active Compounds with Antiviral Properties Extracted from a Bacillus sp
Bacillus
2 references
stated in
Cereusitin A, a cyclic tetrapeptide from a Bacillus cereus strain isolated from the soft coral Antillogorgia (syn. Pseudopterogorgia) elisabethae
stated in
Sattabacins and Sattazolins: New Biologically Active Compounds with Antiviral Properties Extracted from a Bacillus sp
Identifiers
InChI
InChI=1S/C13H18O3/c1-9(2)7-12(15)13(16)8-10-3-5-11(14)6-4-10/h3-6,9,13-14,16H,7-8H2,1-2H3
0 references
InChIKey
IHPFAGHGAJFPOT-UHFFFAOYSA-N
0 references
CAS Registry Number
132992-54-2
0 references
PubChem CID
189899
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IHPFAGHGAJFPOT-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL107420
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IHPFAGHGAJFPOT-UHFFFAOYSA-N
UniChem compound ID
32039470
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID10927890
1 reference
matched by identifier from
InChIKey
InChIKey
IHPFAGHGAJFPOT-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID801356670
0 references
Natural Product Atlas ID
NPA019457
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IHPFAGHGAJFPOT-UHFFFAOYSA-N
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