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(Q60998656)
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English
(7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosapentaenoic acid
chemical compound
17(S)-Hp-DPA(n−3)
17(S)-HpDoPE(n−3)
17(S)-hydroperoxy-ω−3-docosapentaenoic acid
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
362.24570956799994
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₂₂H₃₄O₄
0 references
canonical SMILES
CCC=CCC(C=CC=CCC=CCC=CCCCCCC(=O)O)OO
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
OC(CCCCC/C=C\C/C=C\C/C=C\C=C\[C@H](C/C=C\CC)OO)=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/C22H34O4/c1-2-3-15-18-21(26-25)19-16-13-11-9-7-5-4-6-8-10-12-14-17-20-22(23)24/h3,5-8,11,13,15-16,19,21,25H,2,4,9-10,12,14,17-18,20H2,1H3,(H,23,24)/b7-5-,8-6-,13-11-,15-3-,19-16+/t21-/m0/s1
0 references
InChIKey
PQYYUXHETXYOCV-DKMPAXASSA-N
1 reference
stated in
ChEBI release 2020-09-01
PubChem CID
132282531
1 reference
matched by identifier from
InChIKey
InChIKey
PQYYUXHETXYOCV-DKMPAXASSA-N
ChEBI ID
140226
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C22H34O4/c1-2-3-15-18-21(26-25)19-16-13-11-9-7-5-4-6-8-10-12-14-17-20-22(23)24/h3,5-8,11,13,15-16,19,21,25H,2,4,9-10,12,14,17-18,20H2,1H3,(H,23,24)/b7-5-,8-6-,13-11-,15-3-,19-16+/t21-/m0/s1
UniChem compound ID
164271851
1 reference
stated in
UniChem
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