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(Q77281225)
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English
Aurafuron B
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
(8E)-Aurafuron B
1 reference
based on heuristic
inferred from SMILES
2-Hydroxy-5-(8-hydroxy-7,9,12-trimethyltrideca-1,3,5,9-tetraenyl)-2,4-dimethylfuran-3-one
1 reference
based on heuristic
inferred from SMILES
mass
360.230059504
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₃₂O₄
0 references
canonical SMILES
O=C1C(=C(OC1(O)C)C=CC=CC=CC(C)C(O)C(=CCC(C)C)C)C
0 references
isomeric SMILES
CC1=C(/C=C/C=C\C=C\[C@@H](C)[C@@H](O)/C(C)=C/CC(C)C)OC(C)(O)C1=O
0 references
found in taxon
Stigmatella aurantiaca
1 reference
stated in
Aurafuron A and B, new bioactive polyketides from Stigmatella aurantiaca and Archangium gephyra (Myxobacteria). Fermentation, isolation, physico-chemical properties, structure and biological activity
Identifiers
InChI
InChI=1S/C22H32O4/c1-15(2)13-14-17(4)20(23)16(3)11-9-7-8-10-12-19-18(5)21(24)22(6,25)26-19/h7-12,14-16,20,23,25H,13H2,1-6H3/b8-7-,11-9+,12-10+,17-14+/t16-,20-,22?/m1/s1
0 references
InChIKey
CEFLFJSAQJIEGR-HCPLIJRZSA-N
2 references
stated in
PubChem
PubChem CID
11279879
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
11279879
language of work or name
English
PubChem CID
11279879
2 references
stated in
PubChem
PubChem CID
11279879
language of work or name
English
matched by identifier from
InChIKey
InChIKey
CEFLFJSAQJIEGR-HCPLIJRZSA-N
ChEBI ID
201097
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C22H32O4/c1-15(2)13-14-17(4)20(23)16(3)11-9-7-8-10-12-19-18(5)21(24)22(6,25)26-19/h7-12,14-16,20,23,25H,13H2,1-6H3/b8-7-,11-9+,12-10+,17-14+/t16-,20-,22?/m1/s1
UniChem compound ID
32747640
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA004117
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CEFLFJSAQJIEGR-HCPLIJRZSA-N
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