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(Q105111999)
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English
(1E,5E,8R,11E)-11-formyl-5-methyl-8-prop-1-en-2-ylcyclotetradeca-1,5,11-triene-1-carboxylic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
11-Formyl-5-methyl-8-prop-1-en-2-ylcyclotetradeca-1,5,11-triene-1-carboxylic acid
1 reference
based on heuristic
inferred from SMILES
mass
316.203844756
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₈O₃
0 references
canonical SMILES
O=CC1=CCCC(=CCCC(=CCC(C(=C)C)CC1)C)C(=O)O
0 references
isomeric SMILES
C=C(C)[C@H]1C/C=C(\C)CC/C=C(/C(=O)O)CC/C=C(/C=O)CC1
0 references
found in taxon
Arivela viscosa
1 reference
stated in
A cembranoid diterpene from Cleome viscosa
Identifiers
InChI
InChI=1S/C20H28O3/c1-15(2)18-12-10-16(3)6-4-8-19(20(22)23)9-5-7-17(14-21)11-13-18/h7-8,10,14,18H,1,4-6,9,11-13H2,2-3H3,(H,22,23)/b16-10+,17-7+,19-8+/t18-/m0/s1
0 references
InChIKey
IEWDBOOZNCDGEW-KLMVOVRESA-N
0 references
PubChem CID
162985530
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IEWDBOOZNCDGEW-KLMVOVRESA-N
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