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(Q105115274)
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English
(13E,17Z)-18-bromooctadeca-13,17-dien-5,7,15-triynoic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
fatty acid
0 references
mass
346.056841948
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₁₉BrO₂
0 references
canonical SMILES
O=C(O)CCCC#CC#CCCCCC=CC#CC=CBr
0 references
isomeric SMILES
O=C(O)CCCC#CC#CCCCC/C=C/C#C/C=C\Br
0 references
found in taxon
Petrosia volcano
1 reference
stated in
Antifungal Brominated C18 Acetylenic Acids from the Marine Sponge, Petrosia volcano Hoshino
Identifiers
InChI
InChI=1S/C18H19BrO2/c19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18(20)21/h7,9,15,17H,1-3,5,12,14,16H2,(H,20,21)/b9-7+,17-15-
0 references
InChIKey
ILLQTNBLZVKTRJ-MRASAHJLSA-N
0 references
PubChem CID
10360303
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
33025159
1 reference
stated in
UniChem
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