MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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11-HOME(9)

	Properties	Image
MNX_ID	MNXM101334
reference	chebi:179246
formula	C₁₈H₃₄O₃
global charge	0
mol weight	298.467
InChIKey	MHBZYZVYSHCDLI-NTCAYCPXSA-N
InChI	InChI=1S/C18H34O3/c1-2-3-4-8-11-14-17(19)15-12-9-6-5-7-10-13-16-18(20)21/h12,15,17,19H,2-11,13-14,16H2,1H3,(H,20,21)/b15-12+
SMILES	CCCCCCCC(O)/C=C/CCCCCCCC(=O)O

MNX internals

InChI (mnx)	InChI=1/C18H34O3/c1-2-3-4-8-11-14-17(19)15-12-9-6-5-7-10-13-16-18(20)21/h12,15,17,19H,2-11,13-14,16H2,1H3,(H,20,21)/b15-12+/t17?
SMILES (mnx)	[CH3:1][CH2:2][CH2:3][CH2:4][CH2:8][CH2:11][CH2:14][CH:17](/[CH:15]=[CH:12]/[CH2:9][CH2:6][CH2:5][CH2:7][CH2:10][CH2:13][CH2:16][C:18](=[O:20])[OH:21])[OH:19]

Parent-child relations graph

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

Similar chemical compounds in external resources
Identifier	Description
CHEBI:179246 chebi:179246 MHBZYZVYSHCDLI-NTCAYCPXSA-N	11-HOME(9) (E)-11-hydroxyoctadec-9-enoic acid
lipidmaps:LMFA02000211 lipidmapsM:LMFA02000211 MHBZYZVYSHCDLI-NTCAYCPXSA-N	11-HOME(9) 11-hydroxy-9-octadecenoic acid 9-Octadecenoic acid, 11-hydroxy- FA 18:1 O
envipath:...742beeb0d587 envipathM:...742beeb0d587 MHBZYZVYSHCDLI-NTCAYCPXSA-M	compound 0058538