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(Q105245593)
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English
(1R,2R,4S,5R)-4-bromo-1,2-dichloro-5-[(E)-2-chlorovinyl]-1,5-dimethyl-cyclohexane
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4-Bromo-1,2-dichloro-5-(2-chloroethenyl)-1,5-dimethylcyclohexane
1 reference
based on heuristic
inferred from SMILES
2-bromo-4,5-dichloro-1-[(1E)-2-chloroethenyl]-1,5-dimethylcyclohexane
1 reference
based on heuristic
inferred from SMILES
mass
317.934445588
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Mertensene
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
Coccinene
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₀H₁₄BrCl₃
0 references
canonical SMILES
ClC=CC1(C)CC(Cl)(C)C(Cl)CC1Br
0 references
isomeric SMILES
C[C@]1(/C=C/Cl)C[C@@](C)(Cl)[C@H](Cl)C[C@@H]1Br
0 references
found in taxon
Plocamium hamatum
2 references
stated in
Halogenated Monoterpenes from Plocamium coccineum of Northwest Spain
stated in
Plocamium hamatum and its monoterpenes: chemical and biological investigations of the tropical marine red alga
Plocamium mertensii
1 reference
stated in
Halogenated Monoterpenes from Plocamium coccineum of Northwest Spain
Plocamium cartilagineum
1 reference
stated in
Cytotoxic activity of halogenated monoterpenes from Plocamium cartilagineum.
Gelidium sesquipedale
1 reference
stated in
Gelidene, A New Polyhalogenated Monocyclic Monoterpene from the Red Marine Alga Gelidium sesquipedale
Gelidium corneum
1 reference
stated in
Gelidene, A New Polyhalogenated Monocyclic Monoterpene from the Red Marine Alga Gelidium sesquipedale
Gelidium spinosum
1 reference
stated in
Gelidene, A New Polyhalogenated Monocyclic Monoterpene from the Red Marine Alga Gelidium sesquipedale
Identifiers
InChI
InChI=1S/C10H14BrCl3/c1-9(3-4-12)6-10(2,14)8(13)5-7(9)11/h3-4,7-8H,5-6H2,1-2H3/b4-3+/t7-,8+,9-,10+/m0/s1
0 references
InChIKey
RUGBKCUWZCCZDR-GXFJTLABSA-N
0 references
PubChem CID
6475609
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
RUGBKCUWZCCZDR-GXFJTLABSA-N
UniChem compound ID
45523820
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA020005
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
RUGBKCUWZCCZDR-GXFJTLABSA-N
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