Met007225: PC(15:1(9Z)/0:0)
Metabolite Information
Name
PC(15:1(9Z)/0:0)
IUPAC Name
[(2R)-2-hydroxy-3-[(Z)-pentadec-9-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Molecular Formula
C23H46NO7P
Molecular Weight
479.6
Exact Mass
479.3011898
SMILES
CCCCCC=CCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)O
InChIKey
SUCJIOBGMPMVBJ-MZMPXXGTSA-N
InChI
InChI=1S/C23H46NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-23(26)29-20-22(25)21-31-32(27,28)30-19-18-24(2,3)4/h9-10,22,25H,5-8,11-21H2,1-4H3/b10-9-/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:
Glycerophosphocholines
Crops containing this metabolite
adzuki_bean
banana
broad_bean
broccoli
cabbage
carrot
cauliflower
chestnut
chickpea
citrus
cowpea
eggplant
fig
garlic
grape
kidney_bean
kiwifruit
lemon
lentil
loquat
mango
mung_bean
onion
papaya
parsley
pea
peanut
pineapple
spinach
taro
turnip
watermelon
banana
broad_bean
broccoli
cabbage
carrot
cauliflower
chestnut
chickpea
citrus
cowpea
eggplant
fig
garlic
grape
kidney_bean
kiwifruit
lemon
lentil
loquat
mango
mung_bean
onion
papaya
parsley
pea
peanut
pineapple
spinach
taro
turnip
watermelon
Metabolite Spectrum Accession Label
ADZ00201p
ADZ00290n
BAN00591n
BAN00599n
BAN00635n
BROB00023n
BROB00750p
BROC00057p
BROC00117n
BROC00182n
BROC00541p
CAB00177p
CAB00443n
CAR00420n
CAU00127n
CAU00369p
CHE00307n
CHE00737p
CHI00042p
CHI00061n
CHI00481n
CIT00186n
CIT00327n
COW00019n
COW00486n
COW00629p
EGG00016n
EGG00110p
EGG00170n
FIG00056n
FIG00400n
FIG00465p
GAR00065n
GAR00261n
GRA00149p
KID00287n
KID00371p
KID00656p
KIW00105n
KIW00113p
KIW00558n
LEM00395p
LEN00098n
LEN00548n
LEN00735p
LOQ00114n
LOQ00236n
LOQ00437p
MAN00085n
MAN00601n
MAN00616n
MAN00621n
MUN00368p
MUN00534p
ONI00054n
PAP00133n
PAR00129n
PAR00605n
PAR00874p
PEA00097p
PEA00170n
PEA00411n
PEAN00740n
PIN00066n
PIN00591n
SPI00020n
SPI00324n
SPI00660p
SPI00788p
TAR00101p
TUR00268n
WAT00082n
WAT00185n
ADZ00290n
BAN00591n
BAN00599n
BAN00635n
BROB00023n
BROB00750p
BROC00057p
BROC00117n
BROC00182n
BROC00541p
CAB00177p
CAB00443n
CAR00420n
CAU00127n
CAU00369p
CHE00307n
CHE00737p
CHI00042p
CHI00061n
CHI00481n
CIT00186n
CIT00327n
COW00019n
COW00486n
COW00629p
EGG00016n
EGG00110p
EGG00170n
FIG00056n
FIG00400n
FIG00465p
GAR00065n
GAR00261n
GRA00149p
KID00287n
KID00371p
KID00656p
KIW00105n
KIW00113p
KIW00558n
LEM00395p
LEN00098n
LEN00548n
LEN00735p
LOQ00114n
LOQ00236n
LOQ00437p
MAN00085n
MAN00601n
MAN00616n
MAN00621n
MUN00368p
MUN00534p
ONI00054n
PAP00133n
PAR00129n
PAR00605n
PAR00874p
PEA00097p
PEA00170n
PEA00411n
PEAN00740n
PIN00066n
PIN00591n
SPI00020n
SPI00324n
SPI00660p
SPI00788p
TAR00101p
TUR00268n
WAT00082n
WAT00185n