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(Q105124559)
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English
14,15-Epoxy-5,8,11-eicosatrienoic acid
group of stereoisomers with the chemical formula C₂₀H₃₂O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
320.23514488399996
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₃₂O₃
0 references
canonical SMILES
O=C(O)CCCC=CCC=CCC=CCC1OC1CCCCC
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Identifiers
InChI
InChI=1S/C20H32O3/c1-2-3-12-15-18-19(23-18)16-13-10-8-6-4-5-7-9-11-14-17-20(21)22/h4,6-7,9-10,13,18-19H,2-3,5,8,11-12,14-17H2,1H3,(H,21,22)
0 references
InChIKey
JBSCUHKPLGKXKH-UHFFFAOYSA-N
0 references
CAS Registry Number
81276-03-1
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
1431
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
JBSCUHKPLGKXKH-UHFFFAOYSA-N
ChEBI ID
171866
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H32O3/c1-2-3-12-15-18-19(23-18)16-13-10-8-6-4-5-7-9-11-14-17-20(21)22/h4,6-7,9-10,13,18-19H,2-3,5,8,11-12,14-17H2,1H3,(H,21,22)
UniChem compound ID
23425274
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60868608
1 reference
matched by identifier from
InChIKey
InChIKey
JBSCUHKPLGKXKH-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0242325
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JBSCUHKPLGKXKH-UHFFFAOYSA-N
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