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beta-Dimorphecolic acid

Properties

Image

Occurences in reactions

MNX_ID

MNXM103166

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

formula

C₁₈H₃₂O₃

charge

mass

296.23514

reference

lipidmapsM:LMFA02000187

InChIKey

NPDSHTNEKLQQIJ-RUDINFOGSA-N

InChI

InChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6+,14-11+/t17-/m1/s1

SMILES

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

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
lipidmaps:LMFA02000187 lipidmapsM:LMFA02000187	beta-Dimorphecolic acid (S)- (S)-9-Hydroxy-10-trans,12-trans-octadecadienoic acid (S)-9-Hydroxy-10E,12E-octadecadienoic acid (S)-9-Hydroxy-trans,trans-10,12-octadecadienoic acid (S)-9-Hydroxy-trans,trans-octadecadienoic acid 10,12-Octadecadienoic acid, 9-hydroxy-, [S-(E,E)]- 9S-hydroxy-10E,12E-octadecadienoic acid FA 18:2 O