UCSF

ZINC03860468

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 12 Yes

Popular Name: Glucosamine Hydrochloride Glucosamine Hydrochloride

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1078691-95-8 , 14257-69-3 , 14999-43-0 , 29031-19-4 , 3416-24-8 , 66-84-2 , 66-84-2, 3416-24-8 [gluco , 7772-79-4 , N/A , [14999-43-0]

Other Names:

(+)-2-amino-2-deoxy-D-glucopyranose;(3R,4R,5S,6R)-3-amino-6-(hydroxymethyl)oxane-2,4,5-triol;2-Amino-2-deoxy-D-glucopyranose;2-Amino-2-deoxy-D-Glucose;2-Amino-2-deoxyglucose;2-Aminoglucose;2-Deoxy-2-amino-D-glucose;2-Deoxy-2-aminoglucose;Chitosamine;Cosam

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

14257-69-3; C08349; beta-D-Glucosamine

14999-43-0; D08023; Dona (TN); Glucosamine sulfate

2-Acetamido-2-deoxy-1,3,4,6-tetra-O-acetyl-?-D-glucopyranose

2-Acetamido-2-deoxy-1,3,4,6-tetra-O-acetyl-beta-D-glucopyranose

2-Acetamido-2-deoxy-1,3,4,6-tetra-O-acetyl-^b-D-glucopyranose

2-Amino-2-deoxy-beta-D-glucopyranose;beta-D-Glucosamine

2-amino-2-deoxy-D-glucopyranose

2-Amino-2-deoxy-D-glucose; 2-Amino-2-deoxy-beta-D-glucopyranose; 2-Amino-2-deoxyglucose; Chitosamine; D-Glucosamine; D-Glucose, 2-amino-2-deoxy-; GLUCOSAMINE; Glucosamina [INN-Spanish]; Glucosamine [USAN:INN]; Glucosaminum [INN-Latin]; beta-D-Glucosamine

2-Amino-2-deoxy-D-Glucose; 2-Amino-2-deoxy-D-glucopyranose; 2-Amino-2-deoxyglucose; 2-Aminoglucose; 2-Deoxy-2-amino-D-glucose; 2-Deoxy-2-aminoglucose; Chitosamine; Cosamin; D-(+)-Glucosamine; D-Glucosamine; (+)-2-amino-2-deoxy-D-glucopyranose; (3R,4R,5S,6

2-Amino-2-deoxy-D-glucose; 3416-24-8; C00329; Chitosamine; D-Glucosamine

2-Amino-2-deoxy-D-Glucose;2-Amino-2-deoxy-D-glucopyranose;2-Amino-2-deoxyglucose;2-Aminoglucose;2-Deoxy-2-amino-D-glucose;2-Deoxy-2-aminoglucose;Chitosamine;Cosamin;D-(+)-Glucosamine;D-Glucosamine;(+)-2-amino-2-deoxy-D-glucopyranose;(3R,4R,5S,6R)-3-amino-

3416-24-8; D-Glucosamine; D04334; Glucosamine (USAN/INN)

Anti-D

beta-D-Glucosamine

beta-D-Glucosamine pentaacetate

beta-D-Glucosamine pentaacetate, 96%

cationic chitosan

CHEBI:3599; CHEBI:13964

chitosan

CPD-12539; beta-D-glucosamine

D-(+)-Glucosamine Hydrochloride

D-Glucosamine hydrochloride, 98+%

D-Glucosamine sulfate

D-Glucosamine sulfate sodium salt

Deacetylchitin; [4)-beta-D-GlcpN(1->]n

DNC000223

Glucosamine

Glucosamine sulfate

MFCD00006595

MFCD00050671

MFCD00135831

MFCD02113511

MFCD26593719

MFCD26744380

poliglusam

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -3.35 -10.83 -40.71 7 6 1 118 180.18 1 ↓
Mid Mid (pH 6-8) -3.35 -11.03 -9.03 6 6 0 116 179.172 1 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 184-189? Alfa-Aesar
Melting_Point 184-189° Alfa-Aesar
Mp [°C] 190 - 194 Acros Organics
ALOGPS_SOLUBILITY 5.51e+02 g/l DrugBank-approved
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Therapy antiarthritic SMDC MicroSource
UniProt Database Links CDA1_SCHPO; CDA1_YEAST; CDA2_YEAST; CDA_AMYRO; CDA_CRYNB; CDA_CRYNH; CDA_CRYNJ; CERK1_ARATH; CERK1_ORYSJ; CHIS_BACCI; CHIS_BACSU; CHIS_NOCSP; CHIS_STRSN; CHIT_CARPA; CHXI_ASPFL; DR206_PEA; DRR1_PEA; DRR3_PEA; EBDG_AMYOR; EBDG_HYPJE; EBDG_HYPVI; EBDG_STRAW ChEBI
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.