Met009113: Sedoheptulose
Metabolite Information
Name
Sedoheptulose
IUPAC Name
(3S,4R,5R,6R)-1,3,4,5,6,7-hexahydroxyheptan-2-one
Molecular Formula
C7H14O7
Molecular Weight
210.18
Exact Mass
210.0739528
SMILES
C(C(C(C(C(C(=O)CO)O)O)O)O)O
InChIKey
HSNZZMHEPUFJNZ-SHUUEZRQSA-N
InChI
InChI=1S/C7H14O7/c8-1-3(10)5(12)7(14)6(13)4(11)2-9/h3,5-10,12-14H,1-2H2/t3-,5-,6-,7-/m1/s1
Other Databases Link
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
maize
medicago
adzuki_bean
asparagus
banana
bittermelon
broad_bean
broccoli
cabbage
carrot
cauliflower
chestnut
cucumber
ginger
lentil
lettuce
mango
okra
onion
peanut
perilla
taro
tomato
turnip
watermelon
medicago
adzuki_bean
asparagus
banana
bittermelon
broad_bean
broccoli
cabbage
carrot
cauliflower
chestnut
cucumber
ginger
lentil
lettuce
mango
okra
onion
peanut
perilla
taro
tomato
turnip
watermelon
Metabolite Spectrum Accession Label
MED00870n
ADZ00743n
ASP00584n
BAN00351n
BIT00378p
BROB00223n
BROC00310n
BROC00524n
CAB00143n
CAR00021n
CAR00214n
CAU00029n
CAU00107n
CHE00135n
CHE00650n
CHE00717n
CUC00346n
GIN00260n
LEN00692n
LET00394n
MAN00455n
MAN00546n
OKR00635n
ONI00419n
PEAN00527n
PER01162n
TAR00003p
TOM00142n
TUR00353n
WAT00177n
MZ00167n
ADZ00743n
ASP00584n
BAN00351n
BIT00378p
BROB00223n
BROC00310n
BROC00524n
CAB00143n
CAR00021n
CAR00214n
CAU00029n
CAU00107n
CHE00135n
CHE00650n
CHE00717n
CUC00346n
GIN00260n
LEN00692n
LET00394n
MAN00455n
MAN00546n
OKR00635n
ONI00419n
PEAN00527n
PER01162n
TAR00003p
TOM00142n
TUR00353n
WAT00177n
MZ00167n