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(Q105314407)
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English
(1R,2S,3R,5S,7S)-2-(bromomethyl)-5-[(Z,1R)-1-chlorohex-3-en-5-ynyl]-3-ethyl-4,8-dioxabicyclo[5.1.0]octane
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2-(Bromomethyl)-5-(1-chlorohex-3-en-5-ynyl)-3-ethyl-4,8-dioxabicyclo[5.1.0]octane
1 reference
based on heuristic
inferred from SMILES
mass
346.03351966
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₀BrClO₂
0 references
canonical SMILES
ClC(CC=CC#C)C1OC(CC)C(CBr)C2OC2C1
0 references
isomeric SMILES
C#C/C=C\C[C@@H](Cl)[C@@H]1C[C@@H]2O[C@@H]2[C@@H](CBr)[C@@H](CC)O1
0 references
found in taxon
Laurencia dendroidea
1 reference
stated in
Rogiolenyne A, B, and C: The First Branched Marine C15 Acetogenins. Isolation from the Red SeaweedLaurencia microcladia or the SpongeSpongia zimocca of II Rogiolo
Laurencia microcladia
1 reference
stated in
Rogiolenyne A, B, and C: The First Branched Marine C15 Acetogenins. Isolation from the Red SeaweedLaurencia microcladia or the SpongeSpongia zimocca of II Rogiolo
Identifiers
InChI
InChI=1S/C15H20BrClO2/c1-3-5-6-7-11(17)13-8-14-15(19-14)10(9-16)12(4-2)18-13/h1,5-6,10-15H,4,7-9H2,2H3/b6-5-/t10-,11+,12+,13-,14-,15+/m0/s1
0 references
InChIKey
WWXDSNUMWFIGFH-IRCIXOLMSA-N
0 references
PubChem CID
163186009
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WWXDSNUMWFIGFH-IRCIXOLMSA-N
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