Voglibose Impurity 34

CAT: 1299-RM-V071234-02Size: 25 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-V071234-02Size:25 mg

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CAS Number

83480-29-9

Synonyms

(1S,2S,3R,4S,5S) -5- ((1,3-dihydroxypropan-2-yl) amino) -1- (hydroxymethyl) cyclohexane-1,2,3,4-tetraol

Molecular Formula

C10H21NO7

Molecular Weight

267.28

Target Alternative Name

Voglibose

Product Name Synonym

(1S,2S,3R,4S,5S) -5- ((1,3-dihydroxypropan-2-yl) amino) -1- (hydroxymethyl) cyclohexane-1,2,3,4-tetraol

Chemical Information

Voglibose

Voglibose is an organic molecular entity.

CAS Number	83480-29-9
PubChem CID	444020
IUPAC Name	(1S,2S,3R,4S,5S)-5-(1,3-dihydroxypropan-2-ylamino)-1-(hydroxymethyl)cyclohexane-1,2,3,4-tetrol
Molecular Formula	C10H21NO7
Molecular Weight	267.28
XLogP	-4.1
Topological Polar Surface Area	154
Hydrogen Bond Donor Count	8
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	5
Heavy Atom Count	18
Formal Charge	0
Complexity	263

SMILES

C1[C@@H]([C@@H]([C@H]([C@@H]([C@]1(CO)O)O)O)O)NC(CO)CO

InChI

InChI=1S/C10H21NO7/c12-2-5(3-13)11-6-1-10(18,4-14)9(17)8(16)7(6)15/h5-9,11-18H,1-4H2/t6-,7-,8+,9-,10-/m0/s1

InChIKey

FZNCGRZWXLXZSZ-CIQUZCHMSA-N

Chemical Structure

2D Structure

CAS: 83480-29-9

CID: 444020

Formula: C10H21NO7

MW: 267.28

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	267.28
XLogP3	-4.1
Hydrogen Bond Donor Count	8
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	5
Exact Mass	267.13180201
Monoisotopic Mass	267.13180201
Topological Polar Surface Area	154 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	263
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