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Record Information

Version

5.0

Status

Detected but not Quantified

Creation Date

2021-09-10 22:11:59 UTC

Update Date

2021-09-26 22:53:20 UTC

HMDB ID

HMDB0245095

Secondary Accession Numbers

None

Metabolite Identification

Common Name

beta-D-Galactosamine

Description

3-amino-6-(hydroxymethyl)oxane-2,4,5-triol belongs to the class of organic compounds known as hexoses. These are monosaccharides in which the sugar unit is a is a six-carbon containing moeity. Based on a literature review very few articles have been published on 3-amino-6-(hydroxymethyl)oxane-2,4,5-triol. This compound has been identified in human blood as reported by (PMID: 31557052 ). Beta-d-galactosamine is not a naturally occurring metabolite and is only found in those individuals exposed to this compound or its derivatives. Technically beta-D-Galactosamine is part of the human exposome. The exposome can be defined as the collection of all the exposures of an individual in a lifetime and how those exposures relate to health. An individual's exposure begins before birth and includes insults from environmental and occupational sources.

Structure

MOL 3D MOL SDF 3D SDF PDB 3D PDB SMILES InChI

HEADER    PROTEIN                                 15-JUN-16   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   15-JUN-16         0                                  
HETATM    1  N   UNK     0       1.334   3.850   0.000  0.00  0.00           N+0
HETATM    2  C   UNK     0       1.334   2.310   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       2.667   1.540   0.000  0.00  0.00           C+0
HETATM    4  O   UNK     0       4.001   2.310   0.000  0.00  0.00           O+0
HETATM    5  O   UNK     0       2.667  -0.000   0.000  0.00  0.00           O+0
HETATM    6  C   UNK     0       1.334  -0.770   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       1.334  -2.310   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0       2.667  -3.080   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0       0.000   0.000   0.000  0.00  0.00           C+0
HETATM   10  O   UNK     0      -1.334  -0.770   0.000  0.00  0.00           O+0
HETATM   11  C   UNK     0       0.000   1.540   0.000  0.00  0.00           C+0
HETATM   12  O   UNK     0      -1.334   2.310   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3   11                                                  
CONECT    3    2    4    5                                                  
CONECT    4    3                                                            
CONECT    5    3    6                                                       
CONECT    6    5    7    9                                                  
CONECT    7    6    8                                                       
CONECT    8    7                                                            
CONECT    9    6   10   11                                                  
CONECT   10    9                                                            
CONECT   11    9    2   12                                                  
CONECT   12   11                                                            
MASTER        0    0    0    0    0    0    0    0   12    0   24    0
END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Not Available

Chemical Formula

C₆H₁₃NO₅

Average Molecular Weight

179.172

Monoisotopic Molecular Weight

179.079372523

IUPAC Name

3-amino-6-(hydroxymethyl)oxane-2,4,5-triol

Traditional Name

glucosamine

CAS Registry Number

Not Available

SMILES

NC1C(O)OC(CO)C(O)C1O

InChI Identifier

InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2

InChI Key

MSWZFWKMSRAUBD-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as hexoses. These are monosaccharides in which the sugar unit is a is a six-carbon containing moeity.

Kingdom

Organic compounds

Super Class

Organic oxygen compounds

Class

Organooxygen compounds

Sub Class

Carbohydrates and carbohydrate conjugates

Direct Parent

Hexoses

Alternative Parents

Substituents

Hexose monosaccharide
Amino saccharide
Oxane
1,2-aminoalcohol
Hemiacetal
Secondary alcohol
Polyol
Organoheterocyclic compound
Oxacycle
Primary amine
Primary alcohol
Organopnictogen compound
Organonitrogen compound
Primary aliphatic amine
Organic nitrogen compound
Alcohol
Amine
Hydrocarbon derivative
Aliphatic heteromonocyclic compound

Molecular Framework

Aliphatic heteromonocyclic compounds

External Descriptors

Not Available

Ontology

Not Available

Not Available

Not Available

Not Available

Physical Properties

State

Not Available

Experimental Molecular Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	Not Available	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
logP	-2.7	ALOGPS
logP	-3	ChemAxon
logS	0.49	ALOGPS
pKa (Strongest Acidic)	11.73	ChemAxon
pKa (Strongest Basic)	8.23	ChemAxon
Physiological Charge	1	ChemAxon
Hydrogen Acceptor Count	6	ChemAxon
Hydrogen Donor Count	5	ChemAxon
Polar Surface Area	116.17 Å²	ChemAxon
Rotatable Bond Count	1	ChemAxon
Refractivity	37.58 m³·mol⁻¹	ChemAxon
Polarizability	16.72 Å³	ChemAxon
Number of Rings	1	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DeepCCS	[M+H]+	141.469	30932474
DeepCCS	[M-H]-	138.819	30932474
DeepCCS	[M-2H]-	175.19	30932474
DeepCCS	[M+Na]+	150.594	30932474
AllCCS	[M+H]+	140.8	32859911
AllCCS	[M+H-H2O]+	136.5	32859911
AllCCS	[M+NH4]+	144.8	32859911
AllCCS	[M+Na]+	145.9	32859911
AllCCS	[M-H]-	132.0	32859911
AllCCS	[M+Na-2H]-	133.0	32859911
AllCCS	[M+HCOO]-	134.2	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
beta-D-Galactosamine	NC1C(O)OC(CO)C(O)C1O	1854.9	Standard non polar	33892256
beta-D-Galactosamine	NC1C(O)OC(CO)C(O)C1O	1733.7	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
beta-D-Galactosamine,1TMS,isomer #1	C[Si](C)(C)OC1OC(CO)C(O)C(O)C1N	1851.9	Semi standard non polar	33892256
beta-D-Galactosamine,1TMS,isomer #1	C[Si](C)(C)OC1OC(CO)C(O)C(O)C1N	1597.0	Standard non polar	33892256
beta-D-Galactosamine,1TMS,isomer #1	C[Si](C)(C)OC1OC(CO)C(O)C(O)C1N	3349.7	Standard polar	33892256
beta-D-Galactosamine,1TMS,isomer #2	C[Si](C)(C)OCC1OC(O)C(N)C(O)C1O	1878.3	Semi standard non polar	33892256
beta-D-Galactosamine,1TMS,isomer #2	C[Si](C)(C)OCC1OC(O)C(N)C(O)C1O	1650.7	Standard non polar	33892256
beta-D-Galactosamine,1TMS,isomer #2	C[Si](C)(C)OCC1OC(O)C(N)C(O)C1O	3496.5	Standard polar	33892256
beta-D-Galactosamine,1TMS,isomer #3	C[Si](C)(C)OC1C(CO)OC(O)C(N)C1O	1885.0	Semi standard non polar	33892256
beta-D-Galactosamine,1TMS,isomer #3	C[Si](C)(C)OC1C(CO)OC(O)C(N)C1O	1582.8	Standard non polar	33892256
beta-D-Galactosamine,1TMS,isomer #3	C[Si](C)(C)OC1C(CO)OC(O)C(N)C1O	3408.6	Standard polar	33892256
beta-D-Galactosamine,1TMS,isomer #4	C[Si](C)(C)OC1C(N)C(O)OC(CO)C1O	1874.9	Semi standard non polar	33892256
beta-D-Galactosamine,1TMS,isomer #4	C[Si](C)(C)OC1C(N)C(O)OC(CO)C1O	1594.0	Standard non polar	33892256
beta-D-Galactosamine,1TMS,isomer #4	C[Si](C)(C)OC1C(N)C(O)OC(CO)C1O	3336.3	Standard polar	33892256
beta-D-Galactosamine,1TMS,isomer #5	C[Si](C)(C)NC1C(O)OC(CO)C(O)C1O	1969.7	Semi standard non polar	33892256
beta-D-Galactosamine,1TMS,isomer #5	C[Si](C)(C)NC1C(O)OC(CO)C(O)C1O	1620.9	Standard non polar	33892256
beta-D-Galactosamine,1TMS,isomer #5	C[Si](C)(C)NC1C(O)OC(CO)C(O)C1O	3465.2	Standard polar	33892256
beta-D-Galactosamine,2TMS,isomer #1	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N)C(O)C1O	1860.2	Semi standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #1	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N)C(O)C1O	1732.2	Standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #1	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N)C(O)C1O	2847.1	Standard polar	33892256
beta-D-Galactosamine,2TMS,isomer #10	C[Si](C)(C)NC1C(O)OC(CO)C(O)C1O[Si](C)(C)C	1907.9	Semi standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #10	C[Si](C)(C)NC1C(O)OC(CO)C(O)C1O[Si](C)(C)C	1738.7	Standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #10	C[Si](C)(C)NC1C(O)OC(CO)C(O)C1O[Si](C)(C)C	2790.0	Standard polar	33892256
beta-D-Galactosamine,2TMS,isomer #11	C[Si](C)(C)N(C1C(O)OC(CO)C(O)C1O)[Si](C)(C)C	2071.6	Semi standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #11	C[Si](C)(C)N(C1C(O)OC(CO)C(O)C1O)[Si](C)(C)C	1871.7	Standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #11	C[Si](C)(C)N(C1C(O)OC(CO)C(O)C1O)[Si](C)(C)C	3103.4	Standard polar	33892256
beta-D-Galactosamine,2TMS,isomer #2	C[Si](C)(C)OC1OC(CO)C(O[Si](C)(C)C)C(O)C1N	1831.0	Semi standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #2	C[Si](C)(C)OC1OC(CO)C(O[Si](C)(C)C)C(O)C1N	1699.5	Standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #2	C[Si](C)(C)OC1OC(CO)C(O[Si](C)(C)C)C(O)C1N	2763.4	Standard polar	33892256
beta-D-Galactosamine,2TMS,isomer #3	C[Si](C)(C)OC1OC(CO)C(O)C(O[Si](C)(C)C)C1N	1832.3	Semi standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #3	C[Si](C)(C)OC1OC(CO)C(O)C(O[Si](C)(C)C)C1N	1725.5	Standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #3	C[Si](C)(C)OC1OC(CO)C(O)C(O[Si](C)(C)C)C1N	2702.1	Standard polar	33892256
beta-D-Galactosamine,2TMS,isomer #4	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO)C(O)C1O	1923.4	Semi standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #4	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO)C(O)C1O	1742.7	Standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #4	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO)C(O)C1O	2740.9	Standard polar	33892256
beta-D-Galactosamine,2TMS,isomer #5	C[Si](C)(C)OCC1OC(O)C(N)C(O[Si](C)(C)C)C1O	1838.8	Semi standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #5	C[Si](C)(C)OCC1OC(O)C(N)C(O[Si](C)(C)C)C1O	1734.7	Standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #5	C[Si](C)(C)OCC1OC(O)C(N)C(O[Si](C)(C)C)C1O	2847.9	Standard polar	33892256
beta-D-Galactosamine,2TMS,isomer #6	C[Si](C)(C)OCC1OC(O)C(N)C(O)C1O[Si](C)(C)C	1870.8	Semi standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #6	C[Si](C)(C)OCC1OC(O)C(N)C(O)C1O[Si](C)(C)C	1712.5	Standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #6	C[Si](C)(C)OCC1OC(O)C(N)C(O)C1O[Si](C)(C)C	2904.0	Standard polar	33892256
beta-D-Galactosamine,2TMS,isomer #7	C[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C)C(O)C1O	1945.7	Semi standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #7	C[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C)C(O)C1O	1759.9	Standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #7	C[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C)C(O)C1O	2903.5	Standard polar	33892256
beta-D-Galactosamine,2TMS,isomer #8	C[Si](C)(C)OC1C(CO)OC(O)C(N)C1O[Si](C)(C)C	1826.4	Semi standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #8	C[Si](C)(C)OC1C(CO)OC(O)C(N)C1O[Si](C)(C)C	1710.6	Standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #8	C[Si](C)(C)OC1C(CO)OC(O)C(N)C1O[Si](C)(C)C	2791.1	Standard polar	33892256
beta-D-Galactosamine,2TMS,isomer #9	C[Si](C)(C)NC1C(O)OC(CO)C(O[Si](C)(C)C)C1O	1918.1	Semi standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #9	C[Si](C)(C)NC1C(O)OC(CO)C(O[Si](C)(C)C)C1O	1725.1	Standard non polar	33892256
beta-D-Galactosamine,2TMS,isomer #9	C[Si](C)(C)NC1C(O)OC(CO)C(O[Si](C)(C)C)C1O	2849.3	Standard polar	33892256
beta-D-Galactosamine,3TMS,isomer #1	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N)C(O[Si](C)(C)C)C1O	1855.8	Semi standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #1	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N)C(O[Si](C)(C)C)C1O	1850.7	Standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #1	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N)C(O[Si](C)(C)C)C1O	2487.8	Standard polar	33892256
beta-D-Galactosamine,3TMS,isomer #10	C[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C1O	1938.7	Semi standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #10	C[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C1O	1854.8	Standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #10	C[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C1O	2554.0	Standard polar	33892256
beta-D-Galactosamine,3TMS,isomer #11	C[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C)[Si](C)(C)C)C(O)C1O	2050.1	Semi standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #11	C[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C)[Si](C)(C)C)C(O)C1O	1972.0	Standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #11	C[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C)[Si](C)(C)C)C(O)C1O	2634.0	Standard polar	33892256
beta-D-Galactosamine,3TMS,isomer #12	C[Si](C)(C)NC1C(O)OC(CO)C(O[Si](C)(C)C)C1O[Si](C)(C)C	1913.0	Semi standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #12	C[Si](C)(C)NC1C(O)OC(CO)C(O[Si](C)(C)C)C1O[Si](C)(C)C	1859.1	Standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #12	C[Si](C)(C)NC1C(O)OC(CO)C(O[Si](C)(C)C)C1O[Si](C)(C)C	2417.0	Standard polar	33892256
beta-D-Galactosamine,3TMS,isomer #13	C[Si](C)(C)OC1C(CO)OC(O)C(N([Si](C)(C)C)[Si](C)(C)C)C1O	2042.9	Semi standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #13	C[Si](C)(C)OC1C(CO)OC(O)C(N([Si](C)(C)C)[Si](C)(C)C)C1O	1939.0	Standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #13	C[Si](C)(C)OC1C(CO)OC(O)C(N([Si](C)(C)C)[Si](C)(C)C)C1O	2613.2	Standard polar	33892256
beta-D-Galactosamine,3TMS,isomer #14	C[Si](C)(C)OC1C(O)C(CO)OC(O)C1N([Si](C)(C)C)[Si](C)(C)C	2040.1	Semi standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #14	C[Si](C)(C)OC1C(O)C(CO)OC(O)C1N([Si](C)(C)C)[Si](C)(C)C	1949.3	Standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #14	C[Si](C)(C)OC1C(O)C(CO)OC(O)C1N([Si](C)(C)C)[Si](C)(C)C	2594.9	Standard polar	33892256
beta-D-Galactosamine,3TMS,isomer #2	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N)C(O)C1O[Si](C)(C)C	1863.4	Semi standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #2	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N)C(O)C1O[Si](C)(C)C	1815.6	Standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #2	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N)C(O)C1O[Si](C)(C)C	2531.6	Standard polar	33892256
beta-D-Galactosamine,3TMS,isomer #3	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO[Si](C)(C)C)C(O)C1O	1926.9	Semi standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #3	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO[Si](C)(C)C)C(O)C1O	1877.5	Standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #3	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO[Si](C)(C)C)C(O)C1O	2412.6	Standard polar	33892256
beta-D-Galactosamine,3TMS,isomer #4	C[Si](C)(C)OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1N	1852.2	Semi standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #4	C[Si](C)(C)OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1N	1809.0	Standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #4	C[Si](C)(C)OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1N	2432.4	Standard polar	33892256
beta-D-Galactosamine,3TMS,isomer #5	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO)C(O[Si](C)(C)C)C1O	1924.4	Semi standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #5	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO)C(O[Si](C)(C)C)C1O	1856.4	Standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #5	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO)C(O[Si](C)(C)C)C1O	2404.3	Standard polar	33892256
beta-D-Galactosamine,3TMS,isomer #6	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO)C(O)C1O[Si](C)(C)C	1909.8	Semi standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #6	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO)C(O)C1O[Si](C)(C)C	1900.8	Standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #6	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO)C(O)C1O[Si](C)(C)C	2352.9	Standard polar	33892256
beta-D-Galactosamine,3TMS,isomer #7	C[Si](C)(C)OC1OC(CO)C(O)C(O)C1N([Si](C)(C)C)[Si](C)(C)C	2047.2	Semi standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #7	C[Si](C)(C)OC1OC(CO)C(O)C(O)C1N([Si](C)(C)C)[Si](C)(C)C	1939.5	Standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #7	C[Si](C)(C)OC1OC(CO)C(O)C(O)C1N([Si](C)(C)C)[Si](C)(C)C	2549.5	Standard polar	33892256
beta-D-Galactosamine,3TMS,isomer #8	C[Si](C)(C)OCC1OC(O)C(N)C(O[Si](C)(C)C)C1O[Si](C)(C)C	1854.6	Semi standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #8	C[Si](C)(C)OCC1OC(O)C(N)C(O[Si](C)(C)C)C1O[Si](C)(C)C	1820.6	Standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #8	C[Si](C)(C)OCC1OC(O)C(N)C(O[Si](C)(C)C)C1O[Si](C)(C)C	2543.9	Standard polar	33892256
beta-D-Galactosamine,3TMS,isomer #9	C[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C)C(O)C1O[Si](C)(C)C	1917.2	Semi standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #9	C[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C)C(O)C1O[Si](C)(C)C	1883.8	Standard non polar	33892256
beta-D-Galactosamine,3TMS,isomer #9	C[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C)C(O)C1O[Si](C)(C)C	2481.4	Standard polar	33892256
beta-D-Galactosamine,4TMS,isomer #1	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N)C(O[Si](C)(C)C)C1O[Si](C)(C)C	1880.9	Semi standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #1	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N)C(O[Si](C)(C)C)C1O[Si](C)(C)C	1913.6	Standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #1	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N)C(O[Si](C)(C)C)C1O[Si](C)(C)C	2304.3	Standard polar	33892256
beta-D-Galactosamine,4TMS,isomer #10	C[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C)[Si](C)(C)C)C(O)C1O[Si](C)(C)C	2025.6	Semi standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #10	C[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C)[Si](C)(C)C)C(O)C1O[Si](C)(C)C	2058.6	Standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #10	C[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C)[Si](C)(C)C)C(O)C1O[Si](C)(C)C	2407.7	Standard polar	33892256
beta-D-Galactosamine,4TMS,isomer #11	C[Si](C)(C)OC1C(CO)OC(O)C(N([Si](C)(C)C)[Si](C)(C)C)C1O[Si](C)(C)C	2017.6	Semi standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #11	C[Si](C)(C)OC1C(CO)OC(O)C(N([Si](C)(C)C)[Si](C)(C)C)C1O[Si](C)(C)C	2039.8	Standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #11	C[Si](C)(C)OC1C(CO)OC(O)C(N([Si](C)(C)C)[Si](C)(C)C)C1O[Si](C)(C)C	2330.6	Standard polar	33892256
beta-D-Galactosamine,4TMS,isomer #2	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO[Si](C)(C)C)C(O)C1O[Si](C)(C)C	1901.9	Semi standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #2	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO[Si](C)(C)C)C(O)C1O[Si](C)(C)C	2016.9	Standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #2	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO[Si](C)(C)C)C(O)C1O[Si](C)(C)C	2146.9	Standard polar	33892256
beta-D-Galactosamine,4TMS,isomer #3	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C1O	1928.5	Semi standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #3	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C1O	1956.3	Standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #3	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C1O	2235.7	Standard polar	33892256
beta-D-Galactosamine,4TMS,isomer #4	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N([Si](C)(C)C)[Si](C)(C)C)C(O)C1O	2037.3	Semi standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #4	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N([Si](C)(C)C)[Si](C)(C)C)C(O)C1O	2046.8	Standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #4	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N([Si](C)(C)C)[Si](C)(C)C)C(O)C1O	2324.0	Standard polar	33892256
beta-D-Galactosamine,4TMS,isomer #5	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO)C(O[Si](C)(C)C)C1O[Si](C)(C)C	1910.9	Semi standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #5	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO)C(O[Si](C)(C)C)C1O[Si](C)(C)C	1975.0	Standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #5	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO)C(O[Si](C)(C)C)C1O[Si](C)(C)C	2085.4	Standard polar	33892256
beta-D-Galactosamine,4TMS,isomer #6	C[Si](C)(C)OC1OC(CO)C(O[Si](C)(C)C)C(O)C1N([Si](C)(C)C)[Si](C)(C)C	2039.1	Semi standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #6	C[Si](C)(C)OC1OC(CO)C(O[Si](C)(C)C)C(O)C1N([Si](C)(C)C)[Si](C)(C)C	2037.7	Standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #6	C[Si](C)(C)OC1OC(CO)C(O[Si](C)(C)C)C(O)C1N([Si](C)(C)C)[Si](C)(C)C	2326.5	Standard polar	33892256
beta-D-Galactosamine,4TMS,isomer #7	C[Si](C)(C)OC1OC(CO)C(O)C(O[Si](C)(C)C)C1N([Si](C)(C)C)[Si](C)(C)C	2053.7	Semi standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #7	C[Si](C)(C)OC1OC(CO)C(O)C(O[Si](C)(C)C)C1N([Si](C)(C)C)[Si](C)(C)C	2050.1	Standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #7	C[Si](C)(C)OC1OC(CO)C(O)C(O[Si](C)(C)C)C1N([Si](C)(C)C)[Si](C)(C)C	2306.2	Standard polar	33892256
beta-D-Galactosamine,4TMS,isomer #8	C[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	1919.6	Semi standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #8	C[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	1960.4	Standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #8	C[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	2217.8	Standard polar	33892256
beta-D-Galactosamine,4TMS,isomer #9	C[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C)[Si](C)(C)C)C(O[Si](C)(C)C)C1O	1987.9	Semi standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #9	C[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C)[Si](C)(C)C)C(O[Si](C)(C)C)C1O	2069.8	Standard non polar	33892256
beta-D-Galactosamine,4TMS,isomer #9	C[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C)[Si](C)(C)C)C(O[Si](C)(C)C)C1O	2376.7	Standard polar	33892256
beta-D-Galactosamine,5TMS,isomer #1	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	1929.2	Semi standard non polar	33892256
beta-D-Galactosamine,5TMS,isomer #1	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	2027.6	Standard non polar	33892256
beta-D-Galactosamine,5TMS,isomer #1	C[Si](C)(C)NC1C(O[Si](C)(C)C)OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	1958.6	Standard polar	33892256
beta-D-Galactosamine,5TMS,isomer #2	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N([Si](C)(C)C)[Si](C)(C)C)C(O[Si](C)(C)C)C1O	2075.1	Semi standard non polar	33892256
beta-D-Galactosamine,5TMS,isomer #2	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N([Si](C)(C)C)[Si](C)(C)C)C(O[Si](C)(C)C)C1O	2115.6	Standard non polar	33892256
beta-D-Galactosamine,5TMS,isomer #2	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N([Si](C)(C)C)[Si](C)(C)C)C(O[Si](C)(C)C)C1O	2108.8	Standard polar	33892256
beta-D-Galactosamine,5TMS,isomer #3	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N([Si](C)(C)C)[Si](C)(C)C)C(O)C1O[Si](C)(C)C	2048.5	Semi standard non polar	33892256
beta-D-Galactosamine,5TMS,isomer #3	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N([Si](C)(C)C)[Si](C)(C)C)C(O)C1O[Si](C)(C)C	2111.6	Standard non polar	33892256
beta-D-Galactosamine,5TMS,isomer #3	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N([Si](C)(C)C)[Si](C)(C)C)C(O)C1O[Si](C)(C)C	2142.1	Standard polar	33892256
beta-D-Galactosamine,5TMS,isomer #4	C[Si](C)(C)OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1N([Si](C)(C)C)[Si](C)(C)C	2041.9	Semi standard non polar	33892256
beta-D-Galactosamine,5TMS,isomer #4	C[Si](C)(C)OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1N([Si](C)(C)C)[Si](C)(C)C	2070.1	Standard non polar	33892256
beta-D-Galactosamine,5TMS,isomer #4	C[Si](C)(C)OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1N([Si](C)(C)C)[Si](C)(C)C	2055.2	Standard polar	33892256
beta-D-Galactosamine,5TMS,isomer #5	C[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C)[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	2025.4	Semi standard non polar	33892256
beta-D-Galactosamine,5TMS,isomer #5	C[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C)[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	2106.2	Standard non polar	33892256
beta-D-Galactosamine,5TMS,isomer #5	C[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C)[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	2144.5	Standard polar	33892256
beta-D-Galactosamine,6TMS,isomer #1	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N([Si](C)(C)C)[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	2146.1	Semi standard non polar	33892256
beta-D-Galactosamine,6TMS,isomer #1	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N([Si](C)(C)C)[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	2127.4	Standard non polar	33892256
beta-D-Galactosamine,6TMS,isomer #1	C[Si](C)(C)OCC1OC(O[Si](C)(C)C)C(N([Si](C)(C)C)[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	1953.8	Standard polar	33892256
beta-D-Galactosamine,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1OC(CO)C(O)C(O)C1N	2092.0	Semi standard non polar	33892256
beta-D-Galactosamine,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1OC(CO)C(O)C(O)C1N	1839.1	Standard non polar	33892256
beta-D-Galactosamine,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1OC(CO)C(O)C(O)C1N	3370.4	Standard polar	33892256
beta-D-Galactosamine,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC1OC(O)C(N)C(O)C1O	2140.8	Semi standard non polar	33892256
beta-D-Galactosamine,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC1OC(O)C(N)C(O)C1O	1907.4	Standard non polar	33892256
beta-D-Galactosamine,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC1OC(O)C(N)C(O)C1O	3542.6	Standard polar	33892256
beta-D-Galactosamine,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1C(CO)OC(O)C(N)C1O	2132.8	Semi standard non polar	33892256
beta-D-Galactosamine,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1C(CO)OC(O)C(N)C1O	1808.9	Standard non polar	33892256
beta-D-Galactosamine,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1C(CO)OC(O)C(N)C1O	3437.2	Standard polar	33892256
beta-D-Galactosamine,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1C(N)C(O)OC(CO)C1O	2113.1	Semi standard non polar	33892256
beta-D-Galactosamine,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1C(N)C(O)OC(CO)C1O	1835.3	Standard non polar	33892256
beta-D-Galactosamine,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1C(N)C(O)OC(CO)C1O	3360.9	Standard polar	33892256
beta-D-Galactosamine,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC1C(O)OC(CO)C(O)C1O	2226.2	Semi standard non polar	33892256
beta-D-Galactosamine,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC1C(O)OC(CO)C(O)C1O	1878.6	Standard non polar	33892256
beta-D-Galactosamine,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC1C(O)OC(CO)C(O)C1O	3398.7	Standard polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(O[Si](C)(C)C(C)(C)C)C(N)C(O)C1O	2324.8	Semi standard non polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(O[Si](C)(C)C(C)(C)C)C(N)C(O)C1O	2227.8	Standard non polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(O[Si](C)(C)C(C)(C)C)C(N)C(O)C1O	2906.3	Standard polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1N	2287.5	Semi standard non polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1N	2159.9	Standard non polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1N	2842.2	Standard polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1N	2288.6	Semi standard non polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1N	2184.0	Standard non polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1N	2790.9	Standard polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NC1C(O[Si](C)(C)C(C)(C)C)OC(CO)C(O)C1O	2393.3	Semi standard non polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NC1C(O[Si](C)(C)C(C)(C)C)OC(CO)C(O)C1O	2212.2	Standard non polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NC1C(O[Si](C)(C)C(C)(C)C)OC(CO)C(O)C1O	2789.5	Standard polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OCC1OC(O)C(N)C(O[Si](C)(C)C(C)(C)C)C1O	2302.7	Semi standard non polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OCC1OC(O)C(N)C(O[Si](C)(C)C(C)(C)C)C1O	2227.9	Standard non polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OCC1OC(O)C(N)C(O[Si](C)(C)C(C)(C)C)C1O	2906.8	Standard polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OCC1OC(O)C(N)C(O)C1O[Si](C)(C)C(C)(C)C	2328.7	Semi standard non polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OCC1OC(O)C(N)C(O)C1O[Si](C)(C)C(C)(C)C	2190.8	Standard non polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OCC1OC(O)C(N)C(O)C1O[Si](C)(C)C(C)(C)C	2951.4	Standard polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C(C)(C)C)C(O)C1O	2401.7	Semi standard non polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C(C)(C)C)C(O)C1O	2252.4	Standard non polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C(C)(C)C)C(O)C1O	2913.7	Standard polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1C(CO)OC(O)C(N)C1O[Si](C)(C)C(C)(C)C	2290.0	Semi standard non polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1C(CO)OC(O)C(N)C1O[Si](C)(C)C(C)(C)C	2169.6	Standard non polar	33892256
beta-D-Galactosamine,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1C(CO)OC(O)C(N)C1O[Si](C)(C)C(C)(C)C	2856.4	Standard polar	33892256
beta-D-Galactosamine,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O)C1O	2658.9	Semi standard non polar	33892256
beta-D-Galactosamine,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O)C1O	2672.1	Standard non polar	33892256
beta-D-Galactosamine,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O)C1O	2803.5	Standard polar	33892256
beta-D-Galactosamine,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)NC1C(O)OC(CO)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	2556.8	Semi standard non polar	33892256
beta-D-Galactosamine,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)NC1C(O)OC(CO)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	2516.8	Standard non polar	33892256
beta-D-Galactosamine,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)NC1C(O)OC(CO)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	2667.1	Standard polar	33892256
beta-D-Galactosamine,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1C(CO)OC(O)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C1O	2652.7	Semi standard non polar	33892256
beta-D-Galactosamine,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1C(CO)OC(O)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C1O	2629.9	Standard non polar	33892256
beta-D-Galactosamine,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1C(CO)OC(O)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C1O	2785.9	Standard polar	33892256
beta-D-Galactosamine,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC1OC(O[Si](C)(C)C(C)(C)C)C(N)C(O)C1O[Si](C)(C)C(C)(C)C	2529.5	Semi standard non polar	33892256
beta-D-Galactosamine,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC1OC(O[Si](C)(C)C(C)(C)C)C(N)C(O)C1O[Si](C)(C)C(C)(C)C	2483.5	Standard non polar	33892256
beta-D-Galactosamine,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC1OC(O[Si](C)(C)C(C)(C)C)C(N)C(O)C1O[Si](C)(C)C(C)(C)C	2742.1	Standard polar	33892256
beta-D-Galactosamine,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC1C(O[Si](C)(C)C(C)(C)C)OC(CO)C(O[Si](C)(C)C(C)(C)C)C1O	2567.0	Semi standard non polar	33892256
beta-D-Galactosamine,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC1C(O[Si](C)(C)C(C)(C)C)OC(CO)C(O[Si](C)(C)C(C)(C)C)C1O	2512.3	Standard non polar	33892256
beta-D-Galactosamine,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NC1C(O[Si](C)(C)C(C)(C)C)OC(CO)C(O[Si](C)(C)C(C)(C)C)C1O	2657.7	Standard polar	33892256
beta-D-Galactosamine,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C	2568.4	Semi standard non polar	33892256
beta-D-Galactosamine,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C	2560.1	Standard non polar	33892256
beta-D-Galactosamine,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C	2715.6	Standard polar	33892256
beta-D-Galactosamine,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NC1C(O[Si](C)(C)C(C)(C)C)OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O	2791.6	Semi standard non polar	33892256
beta-D-Galactosamine,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NC1C(O[Si](C)(C)C(C)(C)C)OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O	2768.4	Standard non polar	33892256
beta-D-Galactosamine,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NC1C(O[Si](C)(C)C(C)(C)C)OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O	2642.6	Standard polar	33892256
beta-D-Galactosamine,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OCC1OC(O[Si](C)(C)C(C)(C)C)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O)C1O	2858.1	Semi standard non polar	33892256
beta-D-Galactosamine,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OCC1OC(O[Si](C)(C)C(C)(C)C)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O)C1O	2886.1	Standard non polar	33892256
beta-D-Galactosamine,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OCC1OC(O[Si](C)(C)C(C)(C)C)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O)C1O	2677.3	Standard polar	33892256
beta-D-Galactosamine,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	2872.4	Semi standard non polar	33892256
beta-D-Galactosamine,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	2831.1	Standard non polar	33892256
beta-D-Galactosamine,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	2638.9	Standard polar	33892256
beta-D-Galactosamine,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	2795.7	Semi standard non polar	33892256
beta-D-Galactosamine,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	2774.1	Standard non polar	33892256
beta-D-Galactosamine,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)NC1C(O)OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	2631.1	Standard polar	33892256
beta-D-Galactosamine,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O	2867.6	Semi standard non polar	33892256
beta-D-Galactosamine,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O	2908.6	Standard non polar	33892256
beta-D-Galactosamine,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O	2710.0	Standard polar	33892256
beta-D-Galactosamine,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC1C(O[Si](C)(C)C(C)(C)C)OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	2941.9	Semi standard non polar	33892256
beta-D-Galactosamine,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC1C(O[Si](C)(C)C(C)(C)C)OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	2934.4	Standard non polar	33892256
beta-D-Galactosamine,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC1C(O[Si](C)(C)C(C)(C)C)OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	2542.1	Standard polar	33892256
beta-D-Galactosamine,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC1OC(O[Si](C)(C)C(C)(C)C)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O	3116.3	Semi standard non polar	33892256
beta-D-Galactosamine,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC1OC(O[Si](C)(C)C(C)(C)C)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O	3017.9	Standard non polar	33892256
beta-D-Galactosamine,5TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC1OC(O[Si](C)(C)C(C)(C)C)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O	2602.1	Standard polar	33892256
beta-D-Galactosamine,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OCC1OC(O[Si](C)(C)C(C)(C)C)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C	3091.5	Semi standard non polar	33892256
beta-D-Galactosamine,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OCC1OC(O[Si](C)(C)C(C)(C)C)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C	3047.7	Standard non polar	33892256
beta-D-Galactosamine,5TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OCC1OC(O[Si](C)(C)C(C)(C)C)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C	2619.8	Standard polar	33892256
beta-D-Galactosamine,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3104.6	Semi standard non polar	33892256
beta-D-Galactosamine,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	2963.7	Standard non polar	33892256
beta-D-Galactosamine,5TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	2561.7	Standard polar	33892256
beta-D-Galactosamine,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	3106.7	Semi standard non polar	33892256
beta-D-Galactosamine,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	3041.1	Standard non polar	33892256
beta-D-Galactosamine,5TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OCC1OC(O)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	2622.8	Standard polar	33892256
beta-D-Galactosamine,6TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(O[Si](C)(C)C(C)(C)C)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	3332.9	Semi standard non polar	33892256
beta-D-Galactosamine,6TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(O[Si](C)(C)C(C)(C)C)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	3166.2	Standard non polar	33892256
beta-D-Galactosamine,6TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(O[Si](C)(C)C(C)(C)C)C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	2613.0	Standard polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (Non-derivatized) - 70eV, Positive	splash10-06tr-9300000000-7e2a89f48724cdda814c	2021-09-23	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (TBDMS_2_9) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (TBDMS_2_10) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (TBDMS_2_11) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (TBDMS_3_1) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (TBDMS_3_3) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (TBDMS_3_4) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (TBDMS_3_6) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (TBDMS_3_7) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (TBDMS_3_8) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (TBDMS_3_10) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (TBDMS_3_14) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (TBDMS_4_1) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (TBDMS_4_2) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (TBDMS_4_5) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (TBDMS_4_6) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (TBDMS_4_10) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - beta-D-Galactosamine GC-MS (TBDMS_4_11) - 70eV, Positive	Not Available	2021-11-03	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - beta-D-Galactosamine 10V, Negative-QTOF	splash10-0a4i-9300000000-6c60a7f332602832baaf	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - beta-D-Galactosamine 20V, Negative-QTOF	splash10-0a4i-9200000000-77db29658fe1def3600e	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - beta-D-Galactosamine 40V, Negative-QTOF	splash10-0a4l-9000000000-bd64268dc67588fc1969	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - beta-D-Galactosamine 10V, Positive-QTOF	splash10-01ox-0900000000-400a58d3fc54c3aaa598	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - beta-D-Galactosamine 20V, Positive-QTOF	splash10-022c-9100000000-a61fa7431c3bb2a108d9	2021-10-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - beta-D-Galactosamine 40V, Positive-QTOF	splash10-0006-9000000000-9d850e653d9a1cc1e5ee	2021-10-12	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-10-12	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Not Available

Biospecimen Locations

Blood

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Blood	Detected but not Quantified	Not Quantified	Not Specified	Not Specified	Normal	31557052	details

Abnormal Concentrations

Not Available

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

Not Available

KNApSAcK ID

Not Available

Chemspider ID

719

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

739

PDB ID

Not Available

ChEBI ID

Not Available

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

Barupal DK, Fiehn O: Generating the Blood Exposome Database Using a Comprehensive Text Mining and Database Fusion Approach. Environ Health Perspect. 2019 Sep;127(9):97008. doi: 10.1289/EHP4713. Epub 2019 Sep 26. [PubMed:31557052 ]

Showing metabocard for beta-D-Galactosamine (HMDB0245095)

MOL for HMDB0245095 (beta-D-Galactosamine)

3D MOL for HMDB0245095 (beta-D-Galactosamine)

3D SDF for HMDB0245095 (beta-D-Galactosamine)

3D-SDF for HMDB0245095 (beta-D-Galactosamine)

PDB for HMDB0245095 (beta-D-Galactosamine)

3D PDB for HMDB0245095 (beta-D-Galactosamine)

SMILES for HMDB0245095 (beta-D-Galactosamine)

INCHI for HMDB0245095 (beta-D-Galactosamine)

Structure for HMDB0245095 (beta-D-Galactosamine)

3D Structure for HMDB0245095 (beta-D-Galactosamine)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra