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

Properties

Image

Occurences in reactions

MNX_ID

MNXM114469

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₂₂H₃₂O₅

charge

mass

376.22497

reference

chebi:138602

InChIKey

CEMNNVWBEJGCOI-NXPQULCPSA-N

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-/m1/s1

SMILES

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

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:138602 chebi:138602	7(S)-hydroperoxy-17(R)-hydroxydocosahexaenoic acid (4Z,7S,8E,10Z,13Z,15E,17R,19Z)-7-hydroperoxy-17-hydroxydocosa-4,8,10,13,15,19-hexaenoic acid 7(S)-Hp-17(R)-HDHA 7S-hydroperoxy-17R-HDHA 7S-hydroperoxy-17R-hydroxy-DHA 7S-hydroperoxy-17R-hydroxydocosahexaenoic acid
seed.compound:cpd34550 seedM:cpd34550	(4Z,7S,8E,10Z,13Z,15E,17R,19Z)-7-hydroperoxy17-hydroxydocosa-4,8,10,13,15,19-hexaenoate 7S-hydroperoxy,17R-hydroxy-docosahexaenoate
metacyc.compound:CPD66-74 metacycM:CPD66-74	(7S,17R)-17-hydroxy-7-hydroperoxydocosahexaenoate (4Z,7S,8E,10Z,13Z,15E,17R,19Z)-17-hydroxy-7-hydroperoxydocosa-4,8,10,13,15,19-hexaenoate
seedM:M_cpd34550	secondary/obsolete/fantasy identifier