Met003906: Lactulose

  Metabolite Information

Name
Lactulose
IUPAC Name
(2S,3R,4S,5R,6R)-2-[(2R,3S,4S,5R)-4,5-dihydroxy-2,5-bis(hydroxymethyl)oxolan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Molecular Formula
C12H22O11
Molecular Weight
342.3
Exact Mass
342.1162115
SMILES
C(C1C(C(C(C(O1)OC2C(OC(C2O)(CO)O)CO)O)O)O)O
InChIKey
JCQLYHFGKNRPGE-FCVZTGTOSA-N
InChI
InChI=1S/C12H22O11/c13-1-4-6(16)7(17)8(18)11(21-4)22-9-5(2-14)23-12(20,3-15)10(9)19/h4-11,13-20H,1-3H2/t4-,5-,6+,7+,8-,9-,10+,11+,12-/m1/s1
Other Databases Link
PubChem:11333

  Structure

  2D Structure
  3D Structure

  Classification 

(data sourced from ClassyFire)

Kingdom: Organic compounds
    Superclass: Organic oxygen compounds
        Class: Organooxygen compounds
            Subclass: Carbohydrates and carbohydrate conjugates

  Crops containing this metabolite

adzuki_bean
asparagus
avocado
banana
blueberry
broad_bean
broccoli
cabbage
carrot
cauliflower
chestnut
chickpea
citrus
cowpea
cucumber
eggplant
garlic
ginger
grape
kidney_bean
kiwifruit
lemon
lentil
lettuce
loquat
mango
mung_bean
muskmelon
okra
onion
papaya
parsley
pea
peach
peanut
pear
perilla
pineapple
potato
spinach
taro
tomato
turnip
watermelon
yam

  Metabolite Spectrum Accession Label

ADZ00067n
ADZ00161n
ADZ00181n
ADZ00189n
ADZ00273n
ADZ00760n
ASP00103n
ASP00161n
ASP00173p
ASP00215p
AVO00083n
AVO00398n
AVO00657n
BAN00060p
BAN00090n
BAN00101n
BAN00156p
BAN00165n
BAN00312n
BAN00568n
BAN00600p
BAN00615p
BAN00634p
BAN00650n
BAN00682n
BAN00710n
BAN00723p
BLU00412n
BROB00029n
BROB00088n
BROB00210n
BROB00488n
BROB00574n
BROB00576n
BROB00634n
BROC00135n
BROC00185n
BROC00272n
BROC00285n
BROC00294n
BROC00515n
BROC00723n
CAB00015n
CAB00073n
CAB00192n
CAB00256p
CAR00047n
CAR00051p
CAR00060n
CAR00103p
CAR00122n
CAR00157n
CAR00192n
CAR00197n
CAR00213n
CAR00234n
CAR00244n
CAR00246n
CAR00259n
CAR00292n
CAR00325n
CAR00356n
CAR00391n
CAR00412n
CAR00442p
CAU00139n
CAU00177p
CAU00179n
CHE00314n
CHE00472n
CHE00672n
CHE00694p
CHE00713n
CHI00258n
CHI00409n
CHI00511n
CHI00545n
CHI00685n
CHI00766n
CIT00342n
CIT00464n
CIT00481n
CIT00607n
COW00227n
COW00253n
COW00400n
COW00451n
COW00605n
CUC00238p
CUC00402n
EGG00059n
EGG00116n
EGG00147n
EGG00159p
EGG00384n
EGG00391p
EGG00680n
GAR00003n
GAR00005n
GAR00092p
GAR00103n
GAR00162n
GAR00448n
GAR00519n
GAR00577n
GIN00355n
GIN01036n
GIN01671n
GRA00140p
KID00130n
KID00150n
KID00415n
KID00425n
KIW00137n
KIW00151n
KIW00236p
KIW00316n
KIW00326p
KIW00561n
LEM00081n
LEM00100n
LEM00201n
LEM00454n
LEM00544n
LEM00729p
LEM00903p
LEN00127n
LEN00169n
LEN00190n
LEN00298n
LEN00320n
LEN00344n
LEN00475n
LEN00479n
LEN00609n
LEN00798n
LET00414p
LET00453p
LOQ00025n
LOQ00043p
LOQ00329p
LOQ00343n
LOQ00362n
LOQ00373n
LOQ00446p
MAN00025p
MAN00044n
MAN00098n
MAN00110n
MAN00152n
MAN00187n
MAN00287n
MAN00331n
MAN00377n
MAN00382n
MAN00387n
MAN00406n
MAN00429n
MAN00434n
MAN00439n
MAN00579n
MAN00596n
MAN00607n
MUN00042n
MUN00143n
MUN00159n
MUN00202n
MUN00229n
MUN00420p
MUN00435n
MUN00459p
MUN00571n
MUN00749n
MUN00757n
MUN00777n
MUS00036n
MUS00149n
MUS00190n
MUS00236n
MUS00264n
MUS00272n
MUS00282n
MUS00289n
MUS00307n
MUS00325n
MUS00368n
MUS00371n
MUS00376n
OKR00058n
OKR00130p
OKR00202n
OKR00291n
OKR00292n
OKR00373n
OKR00433n
ONI00048n
ONI00072p
ONI00159n
ONI00273p
ONI00392p
PAP00070p
PAP00086n
PAP00100n
PAP00113n
PAP00125n
PAP00172n
PAP00181n
PAP00194n
PAP00274n
PAP00308n
PAP00323n
PAR00071n
PAR00135n
PAR00163n
PAR00240p
PAR00537n
PAR00596n
PAR00638p
PAR01075n
PAR01086p
PAR01158p
PAR01172p
PAR01190n
PAR01280p
PEACH00055n
PEACH00071n
PEACH00106n
PEACH00153n
PEACH00177p
PEACH00288n
PEACH00344n
PEACH00352n
PEACH00387n
PEACH00412n
PEACH00431n
PEACH00511n
PEACH00531n
PEACH00539p
PEA00018n
PEA00123p
PEA00135n
PEA00147n
PEA00157n
PEA00183n
PEA00185n
PEA00240n
PEA00255p
PEA00317n
PEA00336n
PEA00360p
PEA00427n
PEAN00023n
PEAN00167n
PEAN00180p
PEAN00312n
PEAN00428n
PEAN00504n
PEAN00526n
PEAN00578n
PEAN00738n
PEAN00822n
PEAR00001n
PEAR00166p
PEAR00211p
PEAR00224n
PEAR00253n
PEAR00299n
PEAR00307n
PEAR00310n
PER00274p
PER00712p
PER00892p
PER01166n
PER01639n
PER01818p
PER01853p
PIN00141n
PIN00465n
PIN00479n
PIN00503n
PIN00521n
PIN00592n
PIN00676n
POT00021n
POT00474n
SPI00260p
SPI00270p
TAR00085p
TAR00174p
TAR00258p
TAR00285p
TOM00580p
TUR00126n
TUR00345p
TUR00357n
WAT00004n
WAT00197p
WAT00301n
WAT00347n
WAT00400n
WAT00410p
WAT00427n
YAM00128n
YAM00146n
YAM00342n
YAM00366n