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(Q77565796)
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English
Falconensin I
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
(8-hydroxy-7-methyl-6-oxo-3-prop-1-enyl-8,8a-dihydro-1H-isochromen-7-yl) 4-hydroxy-2-methoxy-6-methylbenzoate
1 reference
based on heuristic
inferred from SMILES
mass
400.152203108
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₂₄O₇
0 references
canonical SMILES
O=C(OC1(C(=O)C=C2C=C(OCC2C1O)C=CC)C)C=3C(OC)=CC(O)=CC3C
0 references
isomeric SMILES
C/C=C/C1=CC2=CC(=O)[C@]([C@H]([C@@H]2CO1)O)(C)OC(=O)C3=C(C=C(C=C3C)O)OC
0 references
found in taxon
Aspergillus falconensis
2 references
stated in
Hydrogenated azaphilones from Emericella falconensis and E. fruticulosa
stated in
Hydrogenated azaphilones from emericella falconensis and E. Fruticulosa
Aspergillus fruticulosus
1 reference
stated in
Hydrogenated azaphilones from Emericella falconensis and E. fruticulosa
Identifiers
InChI
InChI=1S/C22H24O7/c1-5-6-15-8-13-9-18(24)22(3,20(25)16(13)11-28-15)29-21(26)19-12(2)7-14(23)10-17(19)27-4/h5-10,16,20,23,25H,11H2,1-4H3/b6-5+/t16-,20+,22+/m1/s1
0 references
InChIKey
DYYRAKRVBIKBMP-LAACEAOZSA-N
2 references
stated in
PubChem
PubChem CID
11795256
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
11795256
language of work or name
English
PubChem CID
11795256
2 references
stated in
PubChem
PubChem CID
11795256
language of work or name
English
matched by identifier from
InChIKey
InChIKey
DYYRAKRVBIKBMP-LAACEAOZSA-N
ChEBI ID
217829
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C22H24O7/c1-5-6-15-8-13-9-18(24)22(3,20(25)16(13)11-28-15)29-21(26)19-12(2)7-14(23)10-17(19)27-4/h5-10,16,20,23,25H,11H2,1-4H3/b6-5+/t16-,20+,22+/m1/s1
UniChem compound ID
33836983
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA015549
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DYYRAKRVBIKBMP-LAACEAOZSA-N
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