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(Q104912722)
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English
CID 23426372
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
[2-(2-Acetyloxy-3-bromooct-5-enyl)-5-(3-bromopropa-1,2-dienoxy)oxolan-3-yl] acetate
1 reference
based on heuristic
inferred from SMILES
mass
508.009612752
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₆Br₂O₆
0 references
canonical SMILES
O=C(OC(CC1OC(OC=C=CBr)CC1OC(=O)C)C(Br)CC=CCC)C
0 references
isomeric SMILES
CC/C=C/C[C@H](Br)[C@H](C[C@H]1O[C@@H](OC=C=CBr)C[C@H]1OC(C)=O)OC(C)=O
0 references
found in taxon
Laurencia obtusa
1 reference
stated in
Graciosin and graciosallene, two bromoethers from Laurencia obtusa
Laurencia dendroidea
1 reference
stated in
Graciosin and graciosallene, two bromoethers from Laurencia obtusa
Identifiers
InChI
InChI=1S/C19H26Br2O6/c1-4-5-6-8-15(21)16(25-13(2)22)11-17-18(26-14(3)23)12-19(27-17)24-10-7-9-20/h5-6,9-10,15-19H,4,8,11-12H2,1-3H3/b6-5+/t7?,15-,16-,17+,18+,19+/m0/s1
0 references
InChIKey
AIFQKRQNEPGCPM-IRRDIHOGSA-N
0 references
PubChem CID
23426372
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
AIFQKRQNEPGCPM-IRRDIHOGSA-N
UniChem compound ID
45780629
1 reference
stated in
UniChem
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