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(Q105267713)
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English
[(3S,8R,9R,10R)-3,8,10-trihydroxyheptadec-1-en-4,6-diyn-9-yl] acetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3,8,10-Trihydroxyheptadec-1-en-4,6-diyn-9-yl acetate
1 reference
based on heuristic
inferred from SMILES
mass
336.193673996
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₈O₅
0 references
canonical SMILES
O=C(OC(C(O)C#CC#CC(O)C=C)C(O)CCCCCCC)C
0 references
isomeric SMILES
C=C[C@H](O)C#CC#C[C@@H](O)[C@H](OC(C)=O)[C@H](O)CCCCCCC
0 references
found in taxon
Hydrocotyle leucocephala
1 reference
stated in
Immunosuppressive diacetylenes, ceramides and cerebrosides from Hydrocotyle leucocephala
Identifiers
InChI
InChI=1S/C19H28O5/c1-4-6-7-8-9-13-17(22)19(24-15(3)20)18(23)14-11-10-12-16(21)5-2/h5,16-19,21-23H,2,4,6-9,13H2,1,3H3/t16-,17+,18+,19+/m0/s1
0 references
InChIKey
TYSPCPWTSAFCRA-WJFTUGDTSA-N
0 references
PubChem CID
162916937
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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