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(Q110170265)
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English
1-(5-benzyl-1H-pyrrol-2-yl)ethanone
chemical compound
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No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
199.099714036
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₃NO
0 references
canonical SMILES
O=C(C1=CC=C(N1)CC=2C=CC=CC2)C
0 references
found in taxon
Aspergillus sclerotiorum
1 reference
stated in
New Furanone Derivatives and Alkaloids from the Co-Culture of Marine-Derived Fungi Aspergillus sclerotiorum and Penicillium citrinum
Identifiers
InChI
InChI=1S/C13H13NO/c1-10(15)13-8-7-12(14-13)9-11-5-3-2-4-6-11/h2-8,14H,9H2,1H3
0 references
InChIKey
HJJSJGKQRLQTQK-UHFFFAOYSA-N
0 references
PubChem CID
156581411
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HJJSJGKQRLQTQK-UHFFFAOYSA-N
ChEBI ID
206176
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C13H13NO/c1-10(15)13-8-7-12(14-13)9-11-5-3-2-4-6-11/h2-8,14H,9H2,1H3
Natural Product Atlas ID
NPA030294
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HJJSJGKQRLQTQK-UHFFFAOYSA-N
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