1.0
2010-04-08 22:04:52 UTC
2019-11-26 02:56:04 UTC
FDB001182
Cellulose
The most abundant organic material found in plants forming the principal constituent of their cell walls giving them structural strength. Anticaking agent, binding agent and other uses in food.
1,4-beta-D-Glucan
E460
C12H22O11
342.2965
342.116211546
2-(hydroxymethyl)-6-{[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}oxane-3,4,5-triol
cellobiose
9004-34-6
OCC1OC(OC2C(O)C(O)C(O)OC2CO)C(O)C(O)C1O
InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2
GUBGYTABKSRVRQ-UHFFFAOYSA-N
belongs to the class of organic compounds known as o-glycosyl compounds. These are glycoside in which a sugar group is bonded through one carbon to another group via a O-glycosidic bond.
O-glycosyl compounds
Organic compounds
Organic oxygen compounds
Organooxygen compounds
Carbohydrates and carbohydrate conjugates
Aliphatic heteromonocyclic compounds
Acetals
Disaccharides
Hemiacetals
Hydrocarbon derivatives
Oxacyclic compounds
Oxanes
Polyols
Primary alcohols
Secondary alcohols
Acetal
Alcohol
Aliphatic heteromonocyclic compound
Disaccharide
Hemiacetal
Hydrocarbon derivative
O-glycosyl compound
Organoheterocyclic compound
Oxacycle
Oxane
Polyol
Primary alcohol
Secondary alcohol
a disaccharide
Solid
logp
-3.01
logs
0.23
solubility
5.86e+02 g/l
logp
-4.7
pka_strongest_acidic
11.25
pka_strongest_basic
-3
iupac
2-(hydroxymethyl)-6-{[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}oxane-3,4,5-triol
average_mass
342.2965
mono_mass
342.116211546
smiles
OCC1OC(OC2C(O)C(O)C(O)OC2CO)C(O)C(O)C1O
formula
C12H22O11
inchi
InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2
inchikey
GUBGYTABKSRVRQ-UHFFFAOYSA-N
polar_surface_area
189.53
refractivity
68.34
polarizability
31.18
rotatable_bond_count
4
acceptor_count
11
donor_count
8
physiological_charge
0
formal_charge
0
Specdb::EiMs
1305
Specdb::MsMs
8171
Specdb::MsMs
8172
Specdb::MsMs
8173
Specdb::MsMs
8939
Specdb::MsMs
8940
Specdb::MsMs
8941
Specdb::MsMs
9005
Specdb::MsMs
9006
Specdb::MsMs
9007
Specdb::MsMs
9428
Specdb::MsMs
9429
Specdb::MsMs
9430
Specdb::MsMs
9794
Specdb::MsMs
9795
Specdb::MsMs
9796
Specdb::MsMs
9821
Specdb::MsMs
9822
Specdb::MsMs
9823
Specdb::MsMs
10247
Specdb::MsMs
10248
Specdb::MsMs
10249
Specdb::MsMs
14843
Specdb::MsMs
14844
Specdb::MsMs
14845
Specdb::MsMs
15611
Specdb::NmrOneD
4245
Specdb::NmrOneD
4674
Specdb::NmrOneD
196587
Specdb::NmrOneD
196588
Specdb::NmrOneD
196589
Specdb::NmrOneD
196590
Specdb::NmrOneD
196591
Specdb::NmrOneD
196592
Specdb::NmrOneD
196593
Specdb::NmrOneD
196594
Specdb::NmrOneD
196595
Specdb::NmrOneD
196596
Specdb::NmrOneD
196597
Specdb::NmrOneD
196598
Specdb::NmrOneD
196599
Specdb::NmrOneD
196600
Specdb::NmrOneD
196601
Specdb::NmrOneD
196602
Specdb::NmrOneD
196603
Specdb::NmrOneD
196604
Specdb::NmrOneD
196605
Specdb::NmrOneD
196606
Specdb::CMs
24195
Specdb::CMs
41625
Specdb::CMs
116489
Specdb::CMs
117684
Specdb::CMs
123271
Specdb::CMs
124889
Specdb::CMs
126431
Specdb::CMs
126598
Specdb::CMs
127130
Specdb::CMs
822956
Specdb::CMs
822957
Specdb::CMs
822958
Specdb::CMs
822959
Specdb::CMs
822960
Specdb::CMs
822961
Specdb::CMs
822962
Specdb::CMs
822963
Specdb::CMs
822964
Specdb::CMs
822965
Specdb::CMs
822966
Specdb::CMs
822967
Specdb::CMs
822968
Specdb::CMs
822969
Specdb::CMs
822970
Specdb::CMs
822971
HMDB06944
Arabica coffee
Type 1
specific
Coffea arabica
13443
Barley
Type 1
specific
Hordeum vulgare
4513
25600.0
25600.0
25600.0
mg/100 g
Blackcurrant
Type 1
specific
Ribes nigrum
78511
Carob
Type 1
specific
Ceratonia siliqua
20340
3250.0
3250.0
3250.0
mg/100 g
Cherimoya
Type 1
specific
Annona cherimola
49314
4100.0
4100.0
4100.0
mg/100 g
Chicory
Type 1
specific
Cichorium intybus
13427
Cocoa bean
Type 1
specific
Theobroma cacao
3641
Coconut
Type 1
specific
Cocos nucifera
13894
26600.0
26600.0
26600.0
mg/100 g
Common hazelnut
Type 1
specific
Corylus avellana
13451
Common pea
Type 1
specific
Pisum sativum
3888
8500.0
8500.0
8500.0
mg/100 g
Corn
Type 1
specific
Zea mays
4577
Cottonseed
Type 1
specific
Gossypium
3633
2150.0
2150.0
2150.0
mg/100 g
European chestnut
Type 1
specific
Castanea sativa
21020
2100.0
2100.0
2100.0
mg/100 g
Evening primrose
Type 1
specific
Oenothera biennis
3942
27000.0
27000.0
27000.0
mg/100 g
Flaxseed
Type 1
specific
Linum usitatissimum
4006
French plantain
Type 1
specific
Musa X paradisiaca
89151
Garden cress
Type 1
specific
Lepidium sativum
33125
915.0
915.0
915.0
mg/100 g
Garden tomato (var.)
Type 1
specific
Solanum lycopersicum var. lycopersicum
397755
Mexican groundcherry
Type 1
specific
Physalis philadelphica var. immaculata
374021
1330.0
1330.0
1330.0
mg/100 g
Milk (Cow)
Type 2
specific
330.0
330.0
330.0
mg/100 g
Oat
Type 1
specific
Avena sativa
4498
32750.0
35000.0
30500.0
mg/100 g
Peanut
Type 1
specific
Arachis hypogaea
3818
3500.0
3500.0
3500.0
mg/100 g
Pineapple
Type 1
specific
Ananas comosus
4615
485.0
485.0
485.0
mg/100 g
Potato
Type 1
specific
Solanum tuberosum
4113
Purslane
Type 1
specific
Portulaca oleracea
46147
11850.0
11850.0
11850.0
mg/100 g
Quince
Type 1
specific
Cydonia oblonga
36610
Rice
Type 1
specific
Oryza sativa
4530
31865.0
43730.0
20000.0
mg/100 g
Roselle
Type 1
specific
Hibiscus sabdariffa
183260
16800.0
16800.0
16800.0
mg/100 g
Soft-necked garlic
Type 1
specific
Allium sativum L. var. sativum
4682
Sunflower
Type 1
specific
Helianthus annuus
4232
Tamarind
Type 1
specific
Tamarindus indica
58860
2500.0
2500.0
2500.0
mg/100 g
White mustard
Type 1
specific
Sinapis alba
3728
Wild leek
Type 1
specific
Allium ampeloprasum
4681
odorless
Glucosylceramidase
P04062
GBA
hemostat
976