(4Z,7S,8E,10Z,13Z,15E,17S,19Z)-7-hydroperoxy-17-hydroxydocosa-4,8,10,13,15,19-hexaenoic acid (Q76807229)

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chemical compound

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Language	Label	Description	Also known as
English	(4Z,7S,8E,10Z,13Z,15E,17S,19Z)-7-hydroperoxy-17-hydroxydocosa-4,8,10,13,15,19-hexaenoic acid	chemical compound

Statements

instance of

type of chemical entity

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subclass of

chemical compound

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mass

376.22497412399986 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

stereoisomer of

7(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid

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based on heuristic

inferred from InChI

chemical formula

C₂₂H₃₂O₅

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canonical SMILES

CCC=CCC(O)C=CC=CCC=CC=CC(CC=CCCC(=O)O)OO

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CC/C=C\C[C@@H](/C=C/C=C\C/C=C\C=C\[C@H](C/C=C\CCC(=O)O)OO)O

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Identifiers

InChI

InChI=1S/C22H32O5/c1-2-3-10-15-20(23)16-11-7-5-4-6-8-12-17-21(27-26)18-13-9-14-19-22(24)25/h3,5-13,16-17,20-21,23,26H,2,4,14-15,18-19H2,1H3,(H,24,25)/b7-5-,8-6-,10-3-,13-9-,16-11+,17-12+/t20-,21+/m0/s1

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InChIKey

CEMNNVWBEJGCOI-XGTWDWJNSA-N

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PubChem CID

91820193

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matched by identifier from

InChIKey

InChIKey

CEMNNVWBEJGCOI-XGTWDWJNSA-N

UniChem compound ID

100792100

1 reference

stated in

UniChem

 

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