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(Q104199596)
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English
5-[[5-chloro-3-(3,5-dimethylhepta-1,3-dienyl)-8a-hydroxy-7-methyl-6,8-dioxo-1H-isochromen-7-yl]oxy]-3-methyl-5-oxopent-3-enoic acid
group of stereoisomers with the chemical formula C₂₅H₂₉ClO₈
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Statements
instance of
group of stereoisomers
0 references
subclass of
azaphilone
1 reference
inferred from
azaphilone
mass
492.155095568
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₅H₂₉ClO₈
0 references
canonical SMILES
O=C(OC1(C(=O)C(Cl)=C2C=C(OCC2(O)C1=O)C=CC(=CC(C)CC)C)C)C=C(C)CC(=O)O
0 references
found in taxon
Bartalinia robillardoides
1 reference
stated in
Helicusin E, isochromophilone X and isochromophilone XI: new chloroazaphilones produced by the fungus Bartalinia robillardoides strain LF550.
Identifiers
InChI
InChI=1S/C25H29ClO8/c1-6-14(2)9-15(3)7-8-17-12-18-21(26)22(30)24(5,23(31)25(18,32)13-33-17)34-20(29)11-16(4)10-19(27)28/h7-9,11-12,14,32H,6,10,13H2,1-5H3,(H,27,28)
0 references
InChIKey
VMNQERFVALEMDE-UHFFFAOYSA-N
0 references
PubChem CID
163066118
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VMNQERFVALEMDE-UHFFFAOYSA-N
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