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(Q105133390)
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English
(1E,3E)-2-[(3E,7E)-4,8,12-Trimethyl-3,7,11-tridecatrienyl]-1,3-butadiene-1,4-diol diacetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic acyclic ester
0 references
phytane diterpenoid
0 references
mass
388.261359632
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₄H₃₆O₄
0 references
canonical SMILES
O=C(OC=CC(=COC(=O)C)CCC=C(C)CCC=C(C)CCC=C(C)C)C
0 references
isomeric SMILES
CC(=O)O/C=C/C(=C/OC(C)=O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C
1 reference
based on heuristic
inferred from InChI
found in taxon
Caulerpa brownii
1 reference
stated in
Secondary Metabolites from the Marine Alga Caulerpa brownii (Chlorophyta)
Caulerpa trifaria
1 reference
stated in
Monocyclic Diterpenes from the Marine Alga Caulerpa trifaria (Chlorophyta)
Chlorodesmis fastigiata
1 reference
stated in
Acyclic diterpenes containing 3 enol acetate groups from the green algaChlorodesmis fastigiata
Identifiers
InChI
InChI=1S/C24H36O4/c1-19(2)10-7-11-20(3)12-8-13-21(4)14-9-15-24(18-28-23(6)26)16-17-27-22(5)25/h10,12,14,16-18H,7-9,11,13,15H2,1-6H3/b17-16+,20-12+,21-14+,24-18+
0 references
InChIKey
JPYKBSDTHJGBJW-ODLMHDCJSA-N
0 references
PubChem CID
14756342
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JPYKBSDTHJGBJW-ODLMHDCJSA-N
UniChem compound ID
42210959
1 reference
stated in
UniChem
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