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(Q77493390)
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English
But-2,3-dienyl ether of p-hydroxycinnamic acid
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
216.078644244
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₂O₃
0 references
canonical SMILES
O=C(O)C=CC1=CC=C(OCC=C=C)C=C1
0 references
isomeric SMILES
C=C=CCOc1ccc(/C=C/C(=O)O)cc1
0 references
found in taxon
Xylaria
1 reference
stated in
A novel N-cinnamoylcyclopeptide containing an allenic ether from the fungus Xylaria sp. (strain #2508) from the South China Sea
Identifiers
InChI
InChI=1S/C13H12O3/c1-2-3-10-16-12-7-4-11(5-8-12)6-9-13(14)15/h3-9H,1,10H2,(H,14,15)/b9-6+
0 references
InChIKey
KQIPPZMDZCTQNT-RMKNXTFCSA-N
2 references
stated in
PubChem
PubChem CID
15516258
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
15516258
language of work or name
English
PubChem CID
15516258
2 references
stated in
PubChem
PubChem CID
15516258
language of work or name
English
matched by identifier from
InChIKey
InChIKey
KQIPPZMDZCTQNT-RMKNXTFCSA-N
ChEBI ID
211535
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C13H12O3/c1-2-3-10-16-12-7-4-11(5-8-12)6-9-13(14)15/h3-9H,1,10H2,(H,14,15)/b9-6+
UniChem compound ID
483207
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA009985
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KQIPPZMDZCTQNT-RMKNXTFCSA-N
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