Chitobiose octaacetate

CAT: 0926-OC11539-02Size: 500 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0926-OC11539-02Size:500 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

7284-18-6

Synonyms

N, N'-Diacetylchitobiose hexaacetate; Peracetylchitobiose

MDL Number

MFCD00083612

Smiles

CC (=O) N[C@@H]1[C@H] ([C@@H] ([C@H] (O[C@H]1O[C@@H]2[C@H] (O[C@@H] ([C@@H] ([C@H]2OC (=O) C) NC (=O) C) OC (=O) C) COC (=O) C) COC (=O) C) OC (=O) C) OC (=O) C

Molecular Formula

C28H40N2O17

Molecular Weight

676.62 g/mol

Controlled

Chemical Information

[(2R,3S,4R,5R,6R)-5-acetamido-3-[(2S,3R,4R,5S,6R)-3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-4,6-diacetyloxyoxan-2-yl]methyl acetate

CAS Number	7284-18-6
PubChem CID	111284
IUPAC Name	[(2R,3S,4R,5R,6R)-5-acetamido-3-[(2S,3R,4R,5S,6R)-3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-4,6-diacetyloxyoxan-2-yl]methyl acetate
Molecular Formula	C28H40N2O17
Molecular Weight	676.6
XLogP	-1.8
Topological Polar Surface Area	244
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	17
Rotatable Bond Count	18
Heavy Atom Count	47
Formal Charge	0
Complexity	1210

SMILES

CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O[C@@H]2[C@H](O[C@@H]([C@@H]([C@H]2OC(=O)C)NC(=O)C)OC(=O)C)COC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C28H40N2O17/c1-11(31)29-21-26(43-17(7)37)24(20(10-40-14(4)34)45-27(21)44-18(8)38)47-28-22(30-12(2)32)25(42-16(6)36)23(41-15(5)35)19(46-28)9-39-13(3)33/h19-28H,9-10H2,1-8H3,(H,29,31)(H,30,32)/t19-,20-,21-,22-,23-,24-,25-,26-,27+,28+/m1/s1

InChIKey

JUYKRZRMNHWQCD-SKSLZCFZSA-N

Chemical Structure

2D Structure

CAS: 7284-18-6

CID: 111284

Formula: C28H40N2O17

MW: 676.6

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	676.6
XLogP3	-1.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	17
Rotatable Bond Count	18
Exact Mass	676.23269781
Monoisotopic Mass	676.23269781
Topological Polar Surface Area	244 Å²
Heavy Atom Count	47
Formal Charge	0
Complexity	1210
Isotope Atom Count	0
Defined Atom Stereocenter Count	10
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
OC08301-01	Chitobiose dihydrochloride
OL02883-01	Lactose octaacetate
MT05879-01	Trehalose octaacetate
YFA70739-01	Egcg octaacetate
OS03658-01	Sucrose octaacetate
OC05954-01	D-Cellobiose octaacetate
OM16777-01	A-D-Maltose octaacetate
OG28867-01	Beta-Gentiobiose octaacetate
OM04136-01	B-D-Maltose octaacetate
OD07339-01	4-Deoxy-D-chitobiose heptaacetate

Alternative Products

Catalog	Name
C4160	Chitobiose Octaacetate
HY-N7697F	Chitobiose
TRC-C315003-10MG	Chitobiose Dihydrochloride
sc-285283A	Chitobiose 2HCl
HY-N7697B-01	Chitobiose (dihydrochloride)
82/10-0010	Chitobiose-GEL
297290-01	Lactose octaacetate
297088-01	Gentiobiose octaacetate

Chitobiose octaacetate

Chemical Information

Related Products

Alternative Products

Popular Products