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(Q104169623)
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English
(7,12-Dihydroxy-2,2,4,9-tetramethyl-5-oxo-6-oxatricyclo[6.3.1.04,12]dodecan-11-yl) acetate
group of stereoisomers with the chemical formula C₁₇H₂₆O₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
botrydial sesquiterpenoid
1 reference
inferred from
botrydial sesquiterpenoid
mass
326.172938552
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₆O₆
0 references
canonical SMILES
O=C(OC1CC(C)C2C(O)OC(=O)C3(C)CC(C)(C)C1C23O)C
0 references
found in taxon
Botrytis cinerea
1 reference
stated in
Biotransformation of caryophyllene oxide by botrytis cinerea
Identifiers
InChI
InChI=1S/C17H26O6/c1-8-6-10(22-9(2)18)12-15(3,4)7-16(5)14(20)23-13(19)11(8)17(12,16)21/h8,10-13,19,21H,6-7H2,1-5H3
0 references
InChIKey
JKAYIDYCQPINOJ-UHFFFAOYSA-N
0 references
PubChem CID
85257890
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JKAYIDYCQPINOJ-UHFFFAOYSA-N
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