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4,5-epoxy-17R-hydroxy-docosahexaenoate

MNXM147383 is deprecated and replaced by MNXM37135

Properties

Image

Occurences in reactions

MNX_ID

MNXM37135

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	0

formula

C₂₂H₂₉O₄

charge

-1

mass

357.20713

reference

metacycM:CPD66-73

InChIKey

JQSJFHDWAHTRSL-NMDACHMWSA-M

InChI

InChI=1S/C22H30O4/c1-2-3-11-14-19(23)15-12-9-7-5-4-6-8-10-13-16-20-21(26-20)17-18-22(24)25/h3-4,6-13,15-16,19-21,23H,2,5,14,17-18H2,1H3,(H,24,25)/p-1/b6-4-,9-7-,10-8+,11-3-,15-12+,16-13+/t19-,20?,21?/m1/s1

SMILES

CC/C=C\C[C@@H](O)/C=C/C=C\C/C=C\C=C\C=C\C1OC1CCC(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
metacyc.compound:CPD66-73 metacycM:CPD66-73	4,5-epoxy-17R-hydroxy-docosahexaenoate 4,5-epoxy-17R-hydroxy-6E,8E,10Z,13Z,15E19Z-docosahexaenoate 4,5-epoxy-17R-hydroxy-6E,8E,10Z,13Z,15E19Z-docosahexaenoic acid
lipidmaps:LMFA04000078 lipidmapsM:LMFA04000078	4,5-epoxy-17R-HDHA 4,5-epoxy-17R-hydroxy-6E,8E,10Z,13Z,15E,19Z-docosahexaenoic acid FA 22:7 O2
seed.compound:cpd32029 seedM:cpd32029	4,5-epoxy-17R-hydroxy-6E,8E,10Z,13Z,15E19Z-docosahexaenoate 4,5-epoxy-17R-hydroxy-6E,8E,10Z,13Z,15E19Z-docosahexaenoic acid 4,5-epoxy-17R-hydroxy-docosahexaenoate
seedM:M_cpd32029	secondary/obsolete/fantasy identifier