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(Q104934272)
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English
(2E,6S)-6-[(4R,5R)-5-{[(5S)-2,5-dihydroxy-6-oxocyclohex-1-en-1-yl]methyl}-4-hydroxy-4-methylcyclopent-1-en-1-yl]-2-methylhept-2-enal
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
6-{5-[(2,5-dihydroxy-6-oxocyclohex-1-en-1-yl)methyl]-4-hydroxy-4-methylcyclopent-1-en-1-yl}-2-methylhept-2-enal
1 reference
based on heuristic
inferred from SMILES
mass
362.20932406
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₃₀O₅
0 references
canonical SMILES
O=CC(=CCCC(C1=CCC(O)(C)C1CC=2C(=O)C(O)CCC2O)C)C
0 references
isomeric SMILES
C/C(C=O)=C\CC[C@H](C)C1=CC[C@@](C)(O)[C@@H]1CC1=C(O)CC[C@H](O)C1=O
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found in taxon
Alternaria citri
1 reference
stated in
Studies on host-selective toxins produced by a pathotype of Alternaria citri causing brown spot disease of mandarins.
Identifiers
InChI
InChI=1S/C21H30O5/c1-13(12-22)5-4-6-14(2)15-9-10-21(3,26)17(15)11-16-18(23)7-8-19(24)20(16)25/h5,9,12,14,17,19,23-24,26H,4,6-8,10-11H2,1-3H3/b13-5+/t14-,17+,19-,21+/m0/s1
0 references
InChIKey
BFJUMKLBIUGBTH-SCSFNYFKSA-N
0 references
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