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(Q103818832)
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English
Methyl 7-acetyloxy-3a-hydroxy-3-(hydroxymethyl)-1,1,3,5-tetramethyl-2,4,5,6,7,7a-hexahydroindene-4-carboxylate
group of stereoisomers with the chemical formula C₁₈H₃₀O₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
botrydial sesquiterpenoid
1 reference
inferred from
botrydial sesquiterpenoid
mass
342.20423868
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₃₀O₆
0 references
canonical SMILES
O=C(OC1CC(C)C(C(=O)OC)C2(O)C1C(C)(C)CC2(C)CO)C
0 references
found in taxon
Botrytis cinerea
1 reference
stated in
Biotransformation of caryophyllene oxide by botrytis cinerea
Identifiers
InChI
InChI=1S/C18H30O6/c1-10-7-12(24-11(2)20)14-16(3,4)8-17(5,9-19)18(14,22)13(10)15(21)23-6/h10,12-14,19,22H,7-9H2,1-6H3
0 references
InChIKey
DZXAXKUHDLGMSG-UHFFFAOYSA-N
0 references
PubChem CID
75048837
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DZXAXKUHDLGMSG-UHFFFAOYSA-N
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