Potassium 2-deoxy-2-sulfoamino-D-glucose

C₆H₁₂KNO₈SCAS 31284-96-5297.32 g/mol

Open in Covalent MOL file

Alcohol Aldehyde

Properties

Molecular formula: C₆H₁₂KNO₈S
Molar mass: 297.32 g/mol
Exact mass: 296.9921 Da
logP: -4.36Crippen estimate
Polar surface area: 164.4 Å²
H-bond donors / acceptors: 6 / 7
Rotatable bonds: 7
Stereocentres: R, R, S, Rin SMILES atom order

Identifiers

CAS number

31284-96-5

SMILES

[O-]S(=O)(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO.[K+]

InChIKey

LJJZYEPXOXLGNQ-BTVCFUMJSA-N

InChI

InChI=1S/C6H13NO8S.K/c8-1-3(7-16(13,14)15)5(11)6(12)4(10)2-9;/h1,3-7,9-12H,2H2,(H,13,14,15);/t3-,4+,5+,6+;/m0./s1

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Type any one amount. The others follow from the molar mass.

Names and synonyms

2 names

D-Glucose, 2-deoxy-2-(sulfoamino)-, potassium salt (1:1)
D-Glucose, 2-deoxy-2-(sulfoamino)-, monopotassium salt

Work with Potassium 2-deoxy-2-sulfoamino-D-glucose

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Deoxy-2-sulfoamino-D-glucose sodium salt38899-05-785 % similar Glucosamine3416-24-847 % similar D-Glucosamine sulfate14999-43-046 % similar Glucosamine sulfate29031-19-446 % similar L-Mannose10030-80-545 % similar L-Galactose15572-79-945 % similar Altrose1990-29-045 % similar L-Talose23567-25-145 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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