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(Q110169723)
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English
Aspeterreurone A
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
322.120509056
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₁₈O₄
0 references
canonical SMILES
O=C1OC=2C(=C(O)C=3OC(C)C(C3C2C)C)C1=CC=4C=CC=CC4
0 references
isomeric SMILES
Cc1c2c(c(O)c3c1[C@H](C)[C@@H](C)O3)/C(=C/c1ccccc1)C(=O)O2
0 references
found in taxon
Aspergillus terreus
1 reference
stated in
Aspeterreurone A, a Cytotoxic Dihydrobenzofuran-Phenyl Acrylate Hybrid from the Deep-Sea-Derived Fungus Aspergillus terreus CC-S06-18
Identifiers
InChI
InChI=1S/C20H18O4/c1-10-12(3)23-19-15(10)11(2)18-16(17(19)21)14(20(22)24-18)9-13-7-5-4-6-8-13/h4-10,12,21H,1-3H3/b14-9-/t10-,12-/m1/s1
0 references
InChIKey
FDDZRQPWKCYMRP-JLYGRIHLSA-N
0 references
PubChem CID
156015078
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
FDDZRQPWKCYMRP-JLYGRIHLSA-N
ChEBI ID
226600
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H18O4/c1-10-12(3)23-19-15(10)11(2)18-16(17(19)21)14(20(22)24-18)9-13-7-5-4-6-8-13/h4-10,12,21H,1-3H3/b14-9-/t10-,12-/m1/s1
UniChem compound ID
187494471
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA029772
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
FDDZRQPWKCYMRP-JLYGRIHLSA-N
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