Beta-D-Galactose pentaacetate

CAT: 0127-BIG0303-01Size: 100 gDry Ice: NoHazardous: No

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CAS Number

4163-60-4

Synonyms

1,2,3,4,6-Penta-O-acetyl-beta-D-galactopyranoside

MDL Number

MFCD00063259

Purity

98%

Smiles

CC(=O)OC[C@H]1O[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@H]1OC(=O)C

Chemical Information

beta-D-Galactose pentaacetate

See also: 2,3,4,5,6-Penta-O-acetyl-D-glucose (annotation moved to); beta-D-Glucose pentaacetate (annotation moved to).

CAS Number	4163-60-4
PubChem CID	94752
IUPAC Name	[(2R,3S,4S,5R,6S)-3,4,5,6-tetraacetyloxyoxan-2-yl]methyl acetate
Molecular Formula	C16H22O11
Molecular Weight	390.34
XLogP	0.6
Topological Polar Surface Area	141
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	11
Heavy Atom Count	27
Formal Charge	0
Complexity	599

SMILES

CC(=O)OC[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C16H22O11/c1-7(17)22-6-12-13(23-8(2)18)14(24-9(3)19)15(25-10(4)20)16(27-12)26-11(5)21/h12-16H,6H2,1-5H3/t12-,13+,14+,15-,16-/m1/s1

InChIKey

LPTITAGPBXDDGR-LYYZXLFJSA-N

Chemical Structure

2D Structure

CAS: 4163-60-4

CID: 94752

Formula: C16H22O11

MW: 390.34

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	390.34
XLogP3	0.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	11
Exact Mass	390.11621151
Monoisotopic Mass	390.11621151
Topological Polar Surface Area	141 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	599
Isotope Atom Count	0
Defined Atom Stereocenter Count	5
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1012228-01	A-D-Galactose Pentaacetate
BIK9007-01	Beta-D- (+) -Glucose pentaacetate
BIB6096-01	Alpha, beta-D-Mannose pentaacetate
BIG5003-01	D-Galactosamine pentaacetate
OR1037877-01	D-Glucose pentaacetate
BIP1801	Propargyl-PEG5-beta-D-galactose
BICL2141-01	Benzyl ß-D-xylobioside pentaacetate
BUP16814	SS-D-Glucose pentaacetate
OR1015495-01	Alpha-D (+) -Glucose pentaacetate
OR1012258-01	Alpha-D-Mannose Pentaacetate

Catalog	Name
TRC-G155765-2.5G	Beta-D-Galactose Pentaacetate
HY-W039923-01	β-D-Galactose pentaacetate
TSW-00219-01	α-D-Galactose pentaacetate
sc-221479	D-Galactose Pentaacetate
TRC-G155765-25G	b-D-Galactose Pentaacetate
235399-01	B-D-Galactose pentaacetate 98+%
20096	ß-D-Galactose Pentaacetate extrapure, 99%
G00280-01	B-D-Galactose pentaacetate 99%
41878393	Beta-D-Glucose pentaacetate