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Didehydrofalcarinol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
heptadeca-1,9,11,16-tetraen-4,6-diyn-3-ol
1 reference
based on heuristic
inferred from SMILES
mass
240.15141526
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(3S,9Z,11Z)-heptadeca-1,9,11,16-tetraen-4,6-diyn-3-ol
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₇H₂₀O
0 references
canonical SMILES
OC(C#CC#CCC=CC=CCCCC=C)C=C
0 references
isomeric SMILES
C=CCCC/C=C\C=C/CC#CC#C[C@H](O)C=C
0 references
found in taxon
Hedera helix
2 references
stated in
The diacetylene 11,12-dehydrofalcarinol from Hedera helix
stated in
Allergic and irritant contact dermatitis from falcarinol and didehydrofalcarinol in common ivy (Hedera helix L.).
Identifiers
InChI
InChI=1S/C17H20O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17(18)4-2/h3-4,8-11,17-18H,1-2,5-7,12H2/b9-8-,11-10-/t17-/m1/s1
0 references
InChIKey
ADKVNLJOJPLERM-GMBPKHMRSA-N
0 references
PubChem CID
6442009
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
ADKVNLJOJPLERM-GMBPKHMRSA-N
UniChem compound ID
46781125
1 reference
stated in
UniChem
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