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(Q77505206)
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English
Citreopyrone A
bioactive natural product
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
5-(4-Methoxy-3-methyl-6-oxopyran-2-yl)penta-2,4-dienal
1 reference
based on heuristic
inferred from InChIKey
mass
220.073558864
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₁₂O₄
0 references
canonical SMILES
O=CC=CC=CC=1OC(=O)C=C(OC)C1C
0 references
isomeric SMILES
CC1=C(OC(=O)C=C1OC)/C=C/C=C/C=O
0 references
found in taxon
Penicillium citreonigrum
1 reference
stated in
Citreopyrones, New Metabolites of Two Hybrid Strains, KO 0092 and KO 0141, Derived from thePenicilliumSpecies
Penicillium citrioviride
1 reference
stated in
Citreopyrones, New Metabolites of Two Hybrid Strains, KO 0092 and KO 0141, Derived from thePenicilliumSpecies
Identifiers
InChI
InChI=1S/C12H12O4/c1-9-10(6-4-3-5-7-13)16-12(14)8-11(9)15-2/h3-8H,1-2H3/b5-3+,6-4+
0 references
InChIKey
MLFGJPIHJMFFLG-GGWOSOGESA-N
2 references
stated in
PubChem
PubChem CID
10751389
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
10751389
language of work or name
English
PubChem CID
10751389
2 references
stated in
PubChem
PubChem CID
10751389
language of work or name
English
matched by identifier from
InChIKey
InChIKey
MLFGJPIHJMFFLG-GGWOSOGESA-N
ChEBI ID
221065
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C12H12O4/c1-9-10(6-4-3-5-7-13)16-12(14)8-11(9)15-2/h3-8H,1-2H3/b5-3+,6-4+
UniChem compound ID
34141931
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA011787
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MLFGJPIHJMFFLG-GGWOSOGESA-N
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