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(Q104171545)
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English
Banksiamarin A
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
isocoumarin
0 references
mass
264.063388104
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₂O₆
0 references
canonical SMILES
O=C1OC(=CC=2C1=C(O)C(=C(O)C2C)C)C(=O)OC
0 references
found in taxon
Aspergillus banksianus
1 reference
stated in
Banksialactones and Banksiamarins: Isochromanones and Isocoumarins from an Australian Fungus,Aspergillus banksianus
Identifiers
InChI
InChI=1S/C13H12O6/c1-5-7-4-8(12(16)18-3)19-13(17)9(7)11(15)6(2)10(5)14/h4,14-15H,1-3H3
0 references
InChIKey
MBTRIICTTOQTOF-UHFFFAOYSA-N
0 references
PubChem CID
139590042
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MBTRIICTTOQTOF-UHFFFAOYSA-N
ChEBI ID
209800
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C13H12O6/c1-5-7-4-8(12(16)18-3)19-13(17)9(7)11(15)6(2)10(5)14/h4,14-15H,1-3H3
UniChem compound ID
170912982
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA022706
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MBTRIICTTOQTOF-UHFFFAOYSA-N
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