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

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Linolenyl palmitatoleate

	Properties	Image
MNX_ID	MNXM106212
reference	chebi:165664
formula	C₃₄H₆₀O₂
global charge	0
mol weight	500.852
InChIKey	GPBWMJXPYJMKCY-MVXJGUQMSA-N
InChI	InChI=1S/C34H60O2/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-33-36-34(35)32-30-28-26-24-22-20-16-14-12-10-8-6-4-2/h5,7,11,13-14,16-18H,3-4,6,8-10,12,15,19-33H2,1-2H3/b7-5-,13-11-,16-14-,18-17-
SMILES	CC/C=C\C/C=C\C/C=C\CCCCCCCCOC(=O)CCCCCCC/C=C\CCCCCC

MNX internals

InChI (mnx)	InChI=1/C34H60O2/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-33-36-34(35)32-30-28-26-24-22-20-16-14-12-10-8-6-4-2/h5,7,11,13-14,16-18H,3-4,6,8-10,12,15,19-33H2,1-2H3/b7-5-,13-11-,16-14-,18-17-
SMILES (mnx)	[CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:18]\[CH2:19][CH2:21][CH2:23][CH2:25][CH2:27][CH2:29][CH2:31][CH2:33][O:36][C:34]([CH2:32][CH2:30][CH2:28][CH2:26][CH2:24][CH2:22][CH2:20]/[CH:16]=[CH:14]\[CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:35]

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:165664 chebi:165664 GPBWMJXPYJMKCY-MVXJGUQMSA-N	Linolenyl palmitatoleate [(9Z,12Z,15Z)-octadeca-9,12,15-trienyl] (Z)-hexadec-9-enoate
lipidmaps:LMFA07010120 lipidmapsM:LMFA07010120 GPBWMJXPYJMKCY-MVXJGUQMSA-N	Linolenyl palmitatoleate 9Z,12Z,15Z-octadecatrienyl 9Z-hexadecenoate WE 34:4 WE(18:3(9Z,12Z,15Z)/16:1(9Z))