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(Q75063558)
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Butyrolactone VII
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
Ethyl 4-hydroxy-2-[[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]methyl]-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylate
1 reference
based on heuristic
inferred from SMILES
mass
438.167853172
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₅H₂₆O₇
0 references
canonical SMILES
O=C1OC(C(=O)OCC)(C(=C1O)C=2C=CC(O)=CC2)CC3=CC=C(O)C(=C3)CC=C(C)C
0 references
isomeric SMILES
CCOC(=O)[C@]1(Cc2ccc(O)c(CC=C(C)C)c2)OC(=O)C(O)=C1c1ccc(O)cc1
0 references
found in taxon
Aspergillus terreus
2 references
stated in
Butyrolactones from the fungus Aspergillus terreus BCC 4651.
stated in
Butyrolactones from the fungus Aspergillus terreus BCC 4651.
Identifiers
InChI
InChI=1S/C25H26O7/c1-4-31-24(30)25(14-16-6-12-20(27)18(13-16)7-5-15(2)3)21(22(28)23(29)32-25)17-8-10-19(26)11-9-17/h5-6,8-13,26-28H,4,7,14H2,1-3H3/t25-/m1/s1
0 references
InChIKey
VDBCMUZSRZGQBK-RUZDIDTESA-N
2 references
stated in
PubChem
PubChem CID
49800902
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
49800902
language of work or name
English
PubChem CID
49800902
2 references
stated in
PubChem
PubChem CID
49800902
language of work or name
English
matched by identifier from
InChIKey
InChIKey
VDBCMUZSRZGQBK-RUZDIDTESA-N
ChEBI ID
198888
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C25H26O7/c1-4-31-24(30)25(14-16-6-12-20(27)18(13-16)7-5-15(2)3)21(22(28)23(29)32-25)17-8-10-19(26)11-9-17/h5-6,8-13,26-28H,4,7,14H2,1-3H3/t25-/m1/s1
UniChem compound ID
32694820
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA001548
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VDBCMUZSRZGQBK-RUZDIDTESA-N
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