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(Q77491825)
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English
Cladoacetal A
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
11-Methyl-12,13-dioxatricyclo[8.2.1.02,7]trideca-2(7),3,5,8-tetraen-3-ol
1 reference
based on heuristic
inferred from SMILES
mass
204.078644244
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Cladoacetal B
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₂H₁₂O₃
0 references
canonical SMILES
OC1=CC=CC=2C=CC3OC(OC3C)C12
0 references
isomeric SMILES
C[C@H]1O[C@@H]2O[C@H]1C=Cc1cccc(O)c12
0 references
found in taxon
Cladosporium
3 references
stated in
Biologically active polyketide metabolites from an undetermined fungicolous hyphomycete resembling Cladosporium
stated in
Biologically active polyketide metabolites from an undetermined fungicolous hyphomycete resembling Cladosporium
stated in
Biologically active polyketide metabolites from an undetermined fungicolous hyphomycete resembling Cladosporium
Identifiers
InChI
InChI=1S/C12H12O3/c1-7-10-6-5-8-3-2-4-9(13)11(8)12(14-7)15-10/h2-7,10,12-13H,1H3/t7-,10+,12-/m1/s1
0 references
InChIKey
MQNPAODYALMZAI-INNHCVQGSA-N
2 references
stated in
PubChem
PubChem CID
636736
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
636736
language of work or name
English
PubChem CID
636736
2 references
stated in
PubChem
PubChem CID
636736
language of work or name
English
matched by identifier from
InChIKey
InChIKey
MQNPAODYALMZAI-INNHCVQGSA-N
ChEBI ID
210218
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C12H12O3/c1-7-10-6-5-8-3-2-4-9(13)11(8)12(14-7)15-10/h2-7,10,12-13H,1H3/t7-,10+,12-/m1/s1
UniChem compound ID
593251
1 reference
stated in
UniChem
NMRShiftDB structure ID
2535
1 reference
matched by identifier from
InChIKey
InChIKey
MQNPAODYALMZAI-INNHCVQGSA-N
Natural Product Atlas ID
NPA009732
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MQNPAODYALMZAI-INNHCVQGSA-N
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