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(Q105162713)
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Isolaurallene
chemical compound
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
CID 163185403
1 reference
based on heuristic
inferred from SMILES
CID 163193872
1 reference
based on heuristic
inferred from SMILES
CID 5257630
1 reference
based on heuristic
inferred from SMILES
mass
389.98300408
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
CID 163193892
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
AC1LCSGZ
1 reference
based on heuristic
inferred from InChI
Neo-laurallene
1 reference
based on heuristic
inferred from InChI
CID 162987677
1 reference
based on heuristic
inferred from InChI
CID 162987676
1 reference
based on heuristic
inferred from InChI
CID 162987675
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₀Br₂O₂
0 references
canonical SMILES
BrC=C=CC1OC2CC=CCC(Br)C(OC2C1)CC
0 references
isomeric SMILES
CC[C@H]1O[C@H]2C[C@H](C=C=CBr)O[C@H]2C/C=C\C[C@@H]1Br
0 references
found in taxon
Laurencia nipponica
1 reference
stated in
ISOLAURALLENE, A NEW NONTERPENOID C15-BROMOALLENE, FROM THE RED ALGALAURENCIA NIPPONICAYAMADA
Identifiers
InChI
InChI=1S/C15H20Br2O2/c1-2-13-12(17)7-3-4-8-14-15(19-13)10-11(18-14)6-5-9-16/h3-4,6,9,11-15H,2,7-8,10H2,1H3/b4-3-/t5?,11-,12-,13+,14-,15-/m0/s1
0 references
InChIKey
MFIOGNKPHIMUQN-MYZNQJQGSA-N
0 references
PubChem CID
11188500
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MFIOGNKPHIMUQN-MYZNQJQGSA-N
UniChem compound ID
34615993
1 reference
stated in
UniChem
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