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(Q104949234)
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English
methyl (2Z,8Z)-10-[(E)-2-methylbut-2-enoyl]oxydeca-2,8-dien-4,6-diynoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic acyclic ester
0 references
wax monoester
0 references
mass
272.104858992
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₁₆O₄
0 references
canonical SMILES
O=C(OC)C=CC#CC#CC=CCOC(=O)C(=CC)C
0 references
isomeric SMILES
C(/C=C\C#CC#C/C=C\COC(=O)/C(=C/C)/C)(=O)OC
0 references
found in taxon
Solidago canadensis
1 reference
stated in
Polyacetylenes and diterpenes from Solidago canadensis
Baccharis concava
1 reference
stated in
Diterpenoids from chilean Baccharis species
Baccharis paniculata
1 reference
stated in
Diterpenoids from chilean Baccharis species
Bellis perennis
1 reference
stated in
Acetylenes and terpenoids of Bellis perennis
Conyza sumatrensis
1 reference
stated in
Essential Oil ofConyza sumatrensis(Retz) Walk
Solidago chilensis
1 reference
stated in
A Labdan Diterpene from Solidago chilensis Roots
Identifiers
InChI
InChI=1S/C16H16O4/c1-4-14(2)16(18)20-13-11-9-7-5-6-8-10-12-15(17)19-3/h4,9-12H,13H2,1-3H3/b11-9-,12-10-,14-4+
0 references
InChIKey
BYGJMPLSVFUVSR-RXEUAHTNSA-N
0 references
PubChem CID
6475132
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
BYGJMPLSVFUVSR-RXEUAHTNSA-N
ChEBI ID
229165
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C16H16O4/c1-4-14(2)16(18)20-13-11-9-7-5-6-8-10-12-15(17)19-3/h4,9-12H,13H2,1-3H3/b11-9-,12-10-,14-4+
UniChem compound ID
33190643
1 reference
stated in
UniChem
LIPID MAPS ID
LMFA07011190
1 reference
stated in
LIPID MAPS
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
retrieved
15 January 2022
InChIKey
BYGJMPLSVFUVSR-RXEUAHTNSA-N
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