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(Q105328762)
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English
5-(3,8-Dihydroxy-1,5-dimethyl-6-oxabicyclo[3.2.1]octan-8-yl)-3-methylpenta-2,4-dienoic acid
group of stereoisomers with the chemical formula C₁₅H₂₂O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
cyclofarnesoid
1 reference
inferred from
cyclofarnesoid
mass
282.146723804
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₂O₅
0 references
canonical SMILES
O=C(O)C=C(C=CC1(O)C2(OCC1(C)CC(O)C2)C)C
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Identifiers
InChI
InChI=1S/C15H22O5/c1-10(6-12(17)18)4-5-15(19)13(2)7-11(16)8-14(15,3)20-9-13/h4-6,11,16,19H,7-9H2,1-3H3,(H,17,18)
0 references
InChIKey
XIVFQYWMMJWUCD-UHFFFAOYSA-N
0 references
PubChem CID
72833730
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XIVFQYWMMJWUCD-UHFFFAOYSA-N
UniChem compound ID
70398978
1 reference
stated in
UniChem
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