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(Q104402372)
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Chlorofucin
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(1S,3R,4S,6S,7S)-4-bromo-6-chloro-3-ethyl-9-[(2E)-pent-2-en-4-yn-1-yl]-2,8-dioxabicyclo[5.2.1]decane
1 reference
based on heuristic
inferred from SMILES
(1S,3R,4S,6S,7S)-4-bromo-6-chloro-3-ethyl-9-[(2Z)-pent-2-en-4-yn-1-yl]-2,8-dioxabicyclo[5.2.1]decane
1 reference
based on heuristic
inferred from SMILES
4-Bromo-6-chloro-3-ethyl-9-pent-2-en-4-ynyl-2,8-dioxabicyclo[5.2.1]decane
1 reference
based on heuristic
inferred from SMILES
mass
346.03351966
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1S,3R,4S,6S,7S,9R)-4-bromo-6-chloro-3-ethyl-9-pent-2-en-4-ynyl-2,8-dioxabicyclo[5.2.1]decane
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1S,3R,4S,6S,7S,9R)-4-bromo-6-chloro-3-ethyl-9-[(E)-pent-2-en-4-ynyl]-2,8-dioxabicyclo[5.2.1]decane
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
3(Z)-Chlorofucin
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₀BrClO₂
0 references
canonical SMILES
ClC1CC(Br)C(OC2CC1OC2CC=CC#C)CC
0 references
isomeric SMILES
C#C/C=C/C[C@@H]1O[C@H]2C[C@@H]1O[C@H](CC)[C@@H](Br)C[C@@H]2Cl
0 references
found in taxon
Dasyphila
1 reference
stated in
Tropical Marine Algae. X. Isolaurefucin Methyl Ether, a New Lauroxocane Derivative From the Red Alga Dasyphila plumariodes
Laurencia
1 reference
stated in
Antibacterial activity of halogenated sesquiterpenes from Malaysian Laurencia spp.
Laurencia pannosa
1 reference
stated in
Pannosallene, a brominated C15 nonterpenoid from Laurencia pannosa
Identifiers
InChI
InChI=1S/C15H20BrClO2/c1-3-5-6-7-13-15-9-14(19-13)11(17)8-10(16)12(4-2)18-15/h1,5-6,10-15H,4,7-9H2,2H3/b6-5+/t10-,11-,12+,13-,14-,15-/m0/s1
0 references
InChIKey
VRGYZGMXCGNRKB-KZZJSKRPSA-N
0 references
PubChem CID
90475817
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VRGYZGMXCGNRKB-KZZJSKRPSA-N
UniChem compound ID
97497560
1 reference
stated in
UniChem
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