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(Q104969713)
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English
1-(3-Hydroxybut-1-enyl)-2,6,6-trimethylcyclohexane-1,2,4-triol
group of stereoisomers with the chemical formula C₁₃H₂₄O₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
megastigmane
1 reference
inferred from
megastigmane
mass
244.167459248
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₂₄O₄
0 references
canonical SMILES
OC(C=CC1(O)C(O)(C)CC(O)CC1(C)C)C
0 references
found in taxon
Malva sylvestris
1 reference
stated in
Terpenoids and phenol derivatives from Malva silvestris
Ovatus malisuctus
1 reference
stated in
New megastigmane and tetraketide from the leaves of Euscaphis japonica
Identifiers
InChI
InChI=1S/C13H24O4/c1-9(14)5-6-13(17)11(2,3)7-10(15)8-12(13,4)16/h5-6,9-10,14-17H,7-8H2,1-4H3
0 references
InChIKey
CTCKPFXFWVNGLG-UHFFFAOYSA-N
0 references
PubChem CID
72751004
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CTCKPFXFWVNGLG-UHFFFAOYSA-N
UniChem compound ID
70355200
1 reference
stated in
UniChem
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