(Q60998654)

English

(16S,17S)-epoxy-(7Z,10Z,12E,14E,19Z)-docosapentaenoic acid

chemical compound

16(S),17(S)-epoxy-DPA(n−3)

In more languages

Statements

type of chemical entity

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chemical compound

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344.23514488399996 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₂H₃₂O₃

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canonical SMILES

CCC=CCC1OC1C=CC=CC=CCC=CCCCCCC(=O)O

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

OC(CCCCC/C=C\C/C=C\C=C\C=C\[C@@H]1O[C@H]1C/C=C\CC)=O

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subject has role

primary metabolite

1 reference

https://reactome.org/PathwayBrowser/#/R-HSA-1430728&DTAB=MT

Identifiers

InChI=1S/C22H32O3/c1-2-3-14-17-20-21(25-20)18-15-12-10-8-6-4-5-7-9-11-13-16-19-22(23)24/h3,5-8,10,12,14-15,18,20-21H,2,4,9,11,13,16-17,19H2,1H3,(H,23,24)/b7-5-,8-6-,12-10+,14-3-,18-15+/t20-,21-/m0/s1

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AVAZFRKFZXNPMT-HWOJEQMHSA-N

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ChEBI release 2020-09-01

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matched by identifier from

AVAZFRKFZXNPMT-HWOJEQMHSA-N

mapping relation type

1 reference

matched by identifier from

International Chemical Identifier

InChI=1S/C22H32O3/c1-2-3-14-17-20-21(25-20)18-15-12-10-8-6-4-5-7-9-11-13-16-19-22(23)24/h3,5-8,10,12,14-15,18,20-21H,2,4,9,11,13,16-17,19H2,1H3,(H,23,24)/b7-5-,8-6-,12-10+,14-3-,18-15+/t20-,21-/m0/s1

UniChem compound ID

1 reference

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