Met000372: LysoPE(18:2w6/0:0)
Metabolite Information
Name
LysoPE(18:2w6/0:0)
IUPAC Name
[(2R)-3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-hydroxypropyl] (9Z,12Z)-octadeca-9,12-dienoate
Molecular Formula
C23H44NO7P
Molecular Weight
477.6
Exact Mass
477.2855397
SMILES
CCCCCC=CCC=CCCCCCCCC(=O)OCC(COP(=O)(O)OCCN)O
InChIKey
DBHKHNGBVGWQJE-USWSLJGRSA-N
InChI
InChI=1S/C23H44NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(26)29-20-22(25)21-31-32(27,28)30-19-18-24/h6-7,9-10,22,25H,2-5,8,11-21,24H2,1H3,(H,27,28)/b7-6-,10-9-/t22-/m1/s1
Other Databases Link
Structure
2D Structure
3D Structure
Classification
(data sourced from ClassyFire)
Kingdom:
Organic compounds
Superclass:
Lipids and lipid-like molecules
Class:
Glycerophospholipids
Subclass:
Glycerophosphoethanolamines
Crops containing this metabolite
maize
medicago
rice
sweet_potato
morus
s_miltiorrhiza
leonurus
banana
broccoli
chickpea
cucumber
grape
mango
muskmelon
pea
peach
peanut
pear
turnip
watermelon
yam
medicago
rice
sweet_potato
morus
s_miltiorrhiza
leonurus
banana
broccoli
chickpea
cucumber
grape
mango
muskmelon
pea
peach
peanut
pear
turnip
watermelon
yam
Metabolite Spectrum Accession Label
RE01691p
RE01352n
SP01482p
SP01483p
MED06663p
MED03262n
MALB01443n
MALB02352p
BAN00013n
BAN00161p
BAN00164p
BAN00470n
BAN00571n
BAN00612n
BAN00638n
BROC00812n
CHI00121n
CHI00157n
CHI00280n
CHI00310n
CHI00606n
CHI00749p
CHI00767p
CUC00281n
CUC00306n
CUC00351p
GRA00017n
GRA00155n
GRA00235p
GRA00553n
MAN00128n
MAN00225n
MUS00221n
MUS00286n
PEACH00039n
PEACH00204n
PEA00011n
PEA00101n
PEA00126p
PEA00160n
PEA00481n
PEA00486n
PEA00488n
PEA00518n
PEA00548n
PEA00582n
PEAN00080n
PEAN00420n
PEAN00510n
PEAN00819n
PEAN00831n
PEAN00848n
PEAR00176n
PEAR00217n
TUR00029n
TUR00232n
WAT00243n
WAT00320n
YAM00274n
YAM00374n
SMIL03147p
SMIL03148p
LEJAP02942p
LEJAP02943p
LEJAP02944p
LEJAP02397n
MZ01962p
MZ01679n
RE01352n
SP01482p
SP01483p
MED06663p
MED03262n
MALB01443n
MALB02352p
BAN00013n
BAN00161p
BAN00164p
BAN00470n
BAN00571n
BAN00612n
BAN00638n
BROC00812n
CHI00121n
CHI00157n
CHI00280n
CHI00310n
CHI00606n
CHI00749p
CHI00767p
CUC00281n
CUC00306n
CUC00351p
GRA00017n
GRA00155n
GRA00235p
GRA00553n
MAN00128n
MAN00225n
MUS00221n
MUS00286n
PEACH00039n
PEACH00204n
PEA00011n
PEA00101n
PEA00126p
PEA00160n
PEA00481n
PEA00486n
PEA00488n
PEA00518n
PEA00548n
PEA00582n
PEAN00080n
PEAN00420n
PEAN00510n
PEAN00819n
PEAN00831n
PEAN00848n
PEAR00176n
PEAR00217n
TUR00029n
TUR00232n
WAT00243n
WAT00320n
YAM00274n
YAM00374n
SMIL03147p
SMIL03148p
LEJAP02942p
LEJAP02943p
LEJAP02944p
LEJAP02397n
MZ01962p
MZ01679n