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(Q77497230)
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Falconensin M
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) 3,5-dichloro-4-hydroxy-2-methoxy-6-methylbenzoate
1 reference
based on heuristic
inferred from SMILES
mass
468.074258404
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₂₂Cl₂O₇
0 references
canonical SMILES
O=C(OC1(C(=O)C=C2C=C(OCC2C1O)C=CC)C)C=3C(OC)=C(Cl)C(O)=C(Cl)C3C
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(=C3OC)Cl)O)Cl)C
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/C22H22Cl2O7/c1-5-6-12-7-11-8-14(25)22(3,20(27)13(11)9-30-12)31-21(28)15-10(2)16(23)18(26)17(24)19(15)29-4/h5-8,13,20,26-27H,9H2,1-4H3/b6-5+/t13-,20+,22+/m1/s1
0 references
InChIKey
ABDSGQRCBJROHY-PISAZCMYSA-N
2 references
stated in
PubChem
PubChem CID
10695634
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
10695634
language of work or name
English
PubChem CID
10695634
2 references
stated in
PubChem
PubChem CID
10695634
language of work or name
English
matched by identifier from
InChIKey
InChIKey
ABDSGQRCBJROHY-PISAZCMYSA-N
ChEBI ID
214679
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C22H22Cl2O7/c1-5-6-12-7-11-8-14(25)22(3,20(27)13(11)9-30-12)31-21(28)15-10(2)16(23)18(26)17(24)19(15)29-4/h5-8,13,20,26-27H,9H2,1-4H3/b6-5+/t13-,20+,22+/m1/s1
UniChem compound ID
32623083
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA010581
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ABDSGQRCBJROHY-PISAZCMYSA-N
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