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(Q110172182)
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Aspulvinone S
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
448.188588616
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₇H₂₈O₆
0 references
canonical SMILES
O=C1OC(=CC2=CC=C3OC(C)(C)CCC3=C2)C(O)=C1C=4C=C(C(O)=CC4O)CC=C(C)C
0 references
found in taxon
Aspergillus terreus
2 references
stated in
Antimicrobial, antimalarial and anticholinesterase substances from the marine-derived fungus Aspergillus terreus BCC51799
stated in
Studies on the metabolic products of Aspergillus terreus. III. Metabolites of the strain IFO 8835. 1.
Identifiers
InChI
InChI=1S/C27H28O6/c1-15(2)5-7-17-13-19(21(29)14-20(17)28)24-25(30)23(32-26(24)31)12-16-6-8-22-18(11-16)9-10-27(3,4)33-22/h5-6,8,11-14,28-30H,7,9-10H2,1-4H3
0 references
InChIKey
WUYHTTLNJRCPHA-UHFFFAOYSA-N
0 references
PubChem CID
156582875
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
ChEBI ID
216746
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C27H28O6/c1-15(2)5-7-17-13-19(21(29)14-20(17)28)24-25(30)23(32-26(24)31)12-16-6-8-22-18(11-16)9-10-27(3,4)33-22/h5-6,8,11-14,28-30H,7,9-10H2,1-4H3
Natural Product Atlas ID
NPA032170
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WUYHTTLNJRCPHA-UHFFFAOYSA-N
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