Met009640: 2-hydroxyhexadecanoic acid
Metabolite Information
Name
2-hydroxyhexadecanoic acid
IUPAC Name
2-hydroxyhexadecanoic acid
Molecular Formula
C16H32O3
Molecular Weight
272.42
Exact Mass
272.2351449
SMILES
CCCCCCCCCCCCCCC(C(=O)O)O
InChIKey
JGHSBPIZNUXPLA-UHFFFAOYSA-N
InChI
InChI=1S/C16H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(17)16(18)19/h15,17H,2-14H2,1H3,(H,18,19)
Other Databases Link
Structure
2D Structure
3D Structure
Classification
(data sourced from ClassyFire)
Kingdom:
Organic compounds
Superclass:
Lipids and lipid-like molecules
Class:
Fatty Acyls
Subclass:
Fatty acids and conjugates
Crops containing this metabolite
astragalus
maize
medicago
rice
soybean
sweet_potato
wheat
morus
s_miltiorrhiza
leonurus
broad_bean
cauliflower
chickpea
cowpea
garlic
okra
papaya
pea
potato
spinach
yam
maize
medicago
rice
soybean
sweet_potato
wheat
morus
s_miltiorrhiza
leonurus
broad_bean
cauliflower
chickpea
cowpea
garlic
okra
papaya
pea
potato
spinach
yam
Metabolite Spectrum Accession Label
RE00380n
SP00244n
AS00520n
AS00521n
MED01217n
MED01219n
MED01222n
MED01224n
MALB00330n
BROB00008n
CAU00191n
CHI00184n
CHI00276n
CHI00392n
CHI00595n
CHI00633n
CHI00692n
COW00478n
COW00636n
GAR00326n
OKR00235n
PAP00153n
PEA00184n
PEA00388n
PEA00590n
POT00341n
SPI00097n
YAM00050n
SMIL00480n
LEJAP00565n
WT00286n
SY00530n
MZ00334n
SP00244n
AS00520n
AS00521n
MED01217n
MED01219n
MED01222n
MED01224n
MALB00330n
BROB00008n
CAU00191n
CHI00184n
CHI00276n
CHI00392n
CHI00595n
CHI00633n
CHI00692n
COW00478n
COW00636n
GAR00326n
OKR00235n
PAP00153n
PEA00184n
PEA00388n
PEA00590n
POT00341n
SPI00097n
YAM00050n
SMIL00480n
LEJAP00565n
WT00286n
SY00530n
MZ00334n