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

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1-O-(9Z)-hexadecenyl (9Z)-octadecenoate

	Properties	Image
MNX_ID	MNXM107544
reference	chebi:75624
formula	C₃₄H₆₄O₂
global charge	0
mol weight	504.884
InChIKey	XGLAPGGDOHJURU-KXYOHKLBSA-N
InChI	InChI=1S/C34H64O2/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34(35)36-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h14,16-17,19H,3-13,15,18,20-33H2,1-2H3/b16-14-,19-17-
SMILES	CCCCCC/C=C\CCCCCCCCOC(=O)CCCCCCC/C=C\CCCCCCCC

MNX internals

InChI (mnx)	InChI=1/C34H64O2/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34(35)36-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h14,16-17,19H,3-13,15,18,20-33H2,1-2H3/b16-14-,19-17-
SMILES (mnx)	[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15]/[CH:17]=[CH:19]\[CH2:20][CH2:22][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][C:34](=[O:35])[O:36][CH2:33][CH2:31][CH2:29][CH2:27][CH2:25][CH2:23][CH2:21][CH2:18]/[CH:16]=[CH:14]\[CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	1

Similar chemical compounds in external resources
Identifier	Description
CHEBI:75624 chebi:75624 XGLAPGGDOHJURU-KXYOHKLBSA-N	1-O-(9Z)-hexadecenyl (9Z)-octadecenoate (9Z)-hexadec-9-en-1-yl (9Z)-octadec-9-enoate WE(16:1(9Z)/18:1(9Z)) palmitoleyl oleate
SLM:000389272 slm:000389272 XGLAPGGDOHJURU-VCDHSRODSA-N	1-O-(9Z)-hexadecenyl (9Z)-octadecenoate 1-O-palmitoleyl oleate palmitoleyl oleate
lipidmaps:LMFA07010128 lipidmapsM:LMFA07010128 XGLAPGGDOHJURU-KXYOHKLBSA-N	WE 16:1(9Z)/18:1(9Z) 9Z-hexadecenyl 9Z-octadecenoate Palmitoleyl oleate WE 34:2 WE(16:1(9Z)/18:1(9Z))