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(13S)-hydroperoxy-(9Z,11E)-octadecadienoate

Properties

Image

Occurences in reactions

MNX_ID

MNXM1104179

	#reac
in my sandbox	0
in MNXref (generic)	15
in models (compartimentalized)	12

formula

C₁₈H₃₁O₄

charge

-1

mass

311.22278

reference

chebi:57466

InChIKey

JDSRHVWSAMTSSN-IRQZEAMPSA-M

InChI

InChI=1S/C18H32O4/c1-2-3-11-14-17(22-21)15-12-9-7-5-4-6-8-10-13-16-18(19)20/h7,9,12,15,17,21H,2-6,8,10-11,13-14,16H2,1H3,(H,19,20)/p-1/b9-7-,15-12+/t17-/m0/s1

SMILES

CCCCC[C@@H](/C=C/C=C\CCCCCCCC(=O)[O-])OO

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:57466 chebi:57466	(13S)-hydroperoxy-(9Z,11E)-octadecadienoate (9Z,11E,13S)-13-hydroperoxyoctadeca-9,11-dienoate 13(S)-HPODE anion 13(S)-HPODE(1-)
metacyc.compound:13-HYDROPEROXYOCTADECA-911-DIENOATE metacycM:13-HYDROPEROXYOCTADECA-911-DIENOATE	(13S)-HPODE (9Z,11E)-(13S)-13-hydroperoxyoctadeca-9,11-dienoate 13(S)-hydroperoxy-9(Z),11(E)-octadecadienoate
SLM:000000936 slm:000000936	(13S)-hydroperoxy-(9Z,11E)-octadecadienoate (13S)-Hp-(9Z,11E)-ODE (13S)-HpODE
sabiork.compound:7512 sabiorkM:7512	(9Z,11E)-(13S)-13-Hydroperoxyoctadeca-9,11-dienoate 13(S)-HPODE 13S-Hydroperoxy-9Z,11E-octadecadienoic acid
kegg.compound:C04717 keggC:C04717	(9Z,11E)-(13S)-13-Hydroperoxyoctadeca-9,11-dienoic acid (9Z,11E)-(13S)-13-Hydroperoxyoctadeca-9,11-dienoate 13(S)-HPODE 13S-Hydroperoxy-9Z,11E-octadecadienoic acid
bigg.metabolite:C04717 biggM:C04717	13(S)-HPODE(1-)
seed.compound:cpd02873 seedM:cpd02873	13(S)-HPODE (13S)-HPODE (9Z,11E)-(13S)-13-Hydroperoxyoctadeca-9,11-dienoate (9Z,11E)-(13S)-13-Hydroperoxyoctadeca-9,11-dienoic acid (9Z,11E)-(13S)-13-hydroperoxyoctadeca-9,11-dienoate 13(S)-hydroperoxy-9(Z),11(E)-octadecadienoate 13-HPOD 13S-Hydroperoxy-9Z,11E-octadecadienoic acid
CHEBI:15655 chebi:15655	13(S)-HPODE (9Z,11E)-(13S)-13-Hydroperoxyoctadeca-9,11-dienoate (9Z,11E)-(13S)-13-Hydroperoxyoctadeca-9,11-dienoic acid (9Z,11E,13S)-13-hydroperoxyoctadeca-9,11-dienoic acid 13S-Hydroperoxy-9Z,11E-octadecadienoic acid
hmdb:HMDB0003871	13-L-Hydroperoxylinoleic acid (13S,9Z,11E)-13-Hydroperoxy-9,11-octadecadienoate (13S,9Z,11E)-13-Hydroperoxy-9,11-octadecadienoic acid (9Z,11E)-(13S)-13-Hydroperoxyoctadeca-9,11-dienoate (9Z,11E)-(13S)-13-Hydroperoxyoctadeca-9,11-dienoic acid (9Z,11E,13S)-13-Hydroperoxyoctadeca-9,11-dienoate (9Z,11E,13S)-13-Hydroperoxyoctadeca-9,11-dienoic acid (9Z,11E,13S)-13-hydroperoxyoctadeca-9,11-dienoic acid 13(S)-HPODE 13(S)-Hydroperoxy-9Z,11E-octadecadienoate 13(S)-Hydroperoxy-9Z,11E-octadecadienoic acid 13(S)-Hydroperoxylinoleic acid 13-HPOD 13-HpODE 13-Hpode 13-Hydroperoxy-9,11-octadecadienoic acid 13-Hydroperoxy-9,11-octadecadienoic acid, (Z,e)-isomer 13-L-Hydroperoxy-9-cis,11-trans-octadecadienoate 13-L-Hydroperoxy-9-cis,11-trans-octadecadienoic acid 13-L-Hydroperoxy-cis-9,trans-11-octadecadienoate 13-L-Hydroperoxy-cis-9,trans-11-octadecadienoic acid 13-L-Hydroperoxylinoleate 13S-Hydroperoxy-9Z,11E-octadecadienoate 13S-Hydroperoxy-9Z,11E-octadecadienoic acid Hpode Linoleic acid 13(S)-hydroperoxide
lipidmaps:LMFA02000034 lipidmapsM:LMFA02000034	13S-HpODE 13-HpODE 13S-hydroperoxy-9Z,11E-octadecadienoic acid FA 18:2 O2
hmdb:HMDB03871 chebi:10941 chebi:18619 chebi:18620 chebi:264 chebi:39536 biggM:M_C04717 keggC:M_C04717 seedM:M_cpd02873	secondary/obsolete/fantasy identifier