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(Q60998657)
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English
7,8-epoxy,17-hydroxy-(9E,11E,13Z,15E,19Z)-docosapentaenoic acid
chemical compound
7,8-epoxy,17-HDPA(n−3)
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
360.23005950399994
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₂₂H₃₂O₄
0 references
canonical SMILES
CC/C=C\CC(O)/C=C/C=C\C=C\C=C\C1OC1CCCCCC(=O)O
1 reference
based on heuristic
inferred from InChI
isomeric SMILES
OC(CCCCCC1C(/C=C/C=C/C=C\C=C\C(C/C=C\CC)O)O1)=O
0 references
subject has role
primary metabolite
1 reference
stated in
Reactome
reference URL
https://reactome.org/PathwayBrowser/#/R-HSA-1430728&DTAB=MT
Identifiers
InChI
InChI=1S/C22H32O4/c1-2-3-9-14-19(23)15-10-6-4-5-7-11-16-20-21(26-20)17-12-8-13-18-22(24)25/h3-7,9-11,15-16,19-21,23H,2,8,12-14,17-18H2,1H3,(H,24,25)/b6-4-,7-5+,9-3-,15-10+,16-11+
0 references
InChIKey
BZKRUVANVNUJOK-HBVUTLMMSA-N
1 reference
stated in
ChEBI release 2020-09-01
PubChem CID
132282532
1 reference
matched by identifier from
InChIKey
InChIKey
BZKRUVANVNUJOK-HBVUTLMMSA-N
ChEBI ID
140234
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C22H32O4/c1-2-3-9-14-19(23)15-10-6-4-5-7-11-16-20-21(26-20)17-12-8-13-18-22(24)25/h3-7,9-11,15-16,19-21,23H,2,8,12-14,17-18H2,1H3,(H,24,25)/b6-4-,7-5+,9-3-,15-10+,16-11+
UniChem compound ID
164271852
1 reference
stated in
UniChem
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