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(Q82810150)
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English
(3R)-Tetradeca-4,6,12-triene-8,10-diyne-1,3,14-triol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
tetradeca-4,6,12-trien-8,10-diyne-1,3,14-triol
1 reference
based on heuristic
inferred from InChIKey
mass
232.109944372
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(3R,4E,6E,12E)-tetradeca-4,6,12-trien-8,10-diyne-1,3,14-triol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₄H₁₆O₃
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
OCC=CC#CC#CC=CC=CC(O)CCO
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
OCC=CC#CC#CC=CC=C[C@H](O)CCO
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C14H16O3/c15-12-9-7-5-3-1-2-4-6-8-10-14(17)11-13-16/h4,6-10,14-17H,11-13H2/t14-/m0/s1
0 references
InChIKey
QQSKRWNYOUTNSM-AWEZNQCLSA-N
0 references
CAS Registry Number
879096-44-3
0 references
PubChem CID
71405475
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
QQSKRWNYOUTNSM-AWEZNQCLSA-N
UniChem compound ID
54582613
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80826124
1 reference
matched by identifier from
InChIKey
InChIKey
QQSKRWNYOUTNSM-AWEZNQCLSA-N
DSSTOX compound identifier
DTXCID70776866
0 references
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