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(Q82305109)
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NSC329497
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
5'-bromo-2',6,6',6'-tetramethyl-7-oxaspiro[bicyclo[4.1.0]heptane-3,1'-cyclohexan]-2'-ene
1 reference
based on heuristic
inferred from SMILES
mass
298.093227456
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₃BrO
0 references
canonical SMILES
BrC1CC=C(C)C2(CCC3(OC3C2)C)C1(C)C
0 references
isomeric SMILES
CC1=CC[C@H](C([C@]12CC[C@]3([C@@H](C2)O3)C)(C)C)Br
0 references
found in taxon
Chondrophycus glandulifer
1 reference
stated in
The absolute configurations of halogenated chamigrene derivatives from the marine alga, laurencia glandulifera kützing
Identifiers
InChI
InChI=1S/C15H23BrO/c1-10-5-6-11(16)13(2,3)15(10)8-7-14(4)12(9-15)17-14/h5,11-12H,6-9H2,1-4H3/t11-,12-,14+,15+/m1/s1
0 references
InChIKey
VPLRWHUXYUWXPS-UXOAXIEHSA-N
0 references
CAS Registry Number
53767-99-0
0 references
PubChem CID
11969562
1 reference
matched by identifier from
InChIKey
InChIKey
VPLRWHUXYUWXPS-UXOAXIEHSA-N
UniChem compound ID
42953089
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30474932
1 reference
matched by identifier from
InChIKey
InChIKey
VPLRWHUXYUWXPS-UXOAXIEHSA-N
DSSTOX compound identifier
DTXCID70425746
0 references
NSC number
329497
0 references
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