UCSF

ZINC03983907

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2005 15 Yes

Popular Name: N-Acetyl-D-glucosamine N-Acetyl-D-glucosamine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 14215-68-0 , 7512-17-6

Other Names:

.alpha.-D-Galactopyranose, 2-(acetylamino)-2-deoxy-

10036-64-3

134-61-2

1398-61-4

14215-68-0

173382-53-1

1rdn

2-(ACETYLAMINO)-2-DEOXY-A-D-GLUCOPYRANOSE

2-(Acetylamino)-2-deoxyhexopyranose

2-(Acetylamino)-2-deoxyhexose; 2-Acetamido-2-deoxy-D-glucose; 2-Acetamido-2-deoxyglucose; 2-Acetamido-D-glucose; 2-Acetylamino-2-deoxy-D-glucose; Acetylglucosamine; Glcnac; N-Acetylchitosamine; N-Acetylglucosamine; 2-Acetamido-2-deoxy-D-glucopyranose; N-[

2-(Acetylamino)-2-deoxyhexose;2-Acetamido-2-deoxy-D-glucopyranose;2-Acetamido-2-deoxy-D-glucose;2-Acetamido-2-deoxyglucose;2-Acetamido-D-glucose;2-Acetylamino-2-deoxy-D-glucose;Acetylglucosamine;Glcnac;N-Acetylchitosamine;N-Acetylglucosamine;N-[(3R,4R,5S,

2-(Acetylamino)-2-deoxyhexose;2-Acetamido-2-deoxy-D-glucose;2-Acetamido-2-deoxyglucose;2-Acetamido-D-glucose;2-Acetylamino-2-deoxy-D-glucose;Acetylglucosamine;Glcnac;N-Acetylchitosamine;N-Acetylglucosamine;2-Acetamido-2-deoxy-D-glucopyranose;N-[(3R,4R,5S,

2-Acetamido-2-deoxy-b-D-glucose;2-Acetamido-2-deoxy-beta-D-glucose;2-Acetamido-2-deoxy-beta-delta-glucose;b-N-Acetyl-D-glucosamine;b-N-Acetylglucosamine;beta-N-Acetyl-D-glucosamine;beta-N-Acetyl-delta-glucosamine;beta-N-Acetylglucosamine;N-Acetyl-b-D-gluc

2-acetamido-2-deoxy-beta-D-glucopyranose

2-ACETAMIDO-2-DEOXY-D-ALLOSE

2-acetamido-2-deoxy-D-glucopyranose

2-Acetamido-2-deoxy-D-glucopyranose, 98%

2-Acetamido-2-deoxy-D-glucose

2-Acetamido-2-deoxy-D-glucose; 2-Acetamido-2-deoxyglucose; 2-Acetamido-D-glucose; 2-Acetylamino-2-deoxy-D-glucose; AI3-51898; Acetylglucosamine; D-Glucose, 2-(acetylamino)-2-deoxy-; D-Glucose, 2-acetamido-2-deoxy-; EINECS 231-368-2; LS-183152; N-Acetyl-D-

2-Acetamido-2-deoxy-D-glucose; 2-Acetamido-2-deoxyglucose; 2-Acetamido-D-glucose; 2-Acetylamino-2-deoxy-D-glucose; AI3-51898; Acetylglucosamine; D-Glucose, 2-(acetylamino)-2-deoxy-; D-Glucose, 2-acetamido-2-deoxy-; GlcNAc; N-ACETYLGLUCOSAMINE; N-Acetyl-D-

2-Acetamido-2-deoxy-D-glucose; 2-Acetylamino-2-deoxy-D-glucose; Acetylglucosamine; GlcNAc-beta; N-Acetyl-D-glucosamine; N-Acetyl-D-hexosamine; N-acetyl-beta-D-glucosamine; N-acetylglucosamine; betaGlcNAc

2-Acetamido-2-deoxy-D-glucose; 7512-17-6; C00140; GlcNAc; N-Acetyl-D-glucosamine; N-Acetylchitosamine

2-Acetamido-2-deoxy-D-glucose; GlcNAc; N-Acetyl-D-glucosamine; N-Acetylchitosamine; N-acetyl-D-glucosamine

2-Acetamido-2-deoxyglucose

2-acetamido-2-deoxyhexopyranose

2-Acetamido-D-glucose

2-Acetylamino-2-deoxy-D-glucose

20880-45-9

6-Acetamido-6-deoxy-.alpha.-D-glucopyranose

6-Acetamido-6-deoxy-acpha-D-glucopyranose

7132-76-5

7512-17-6

7512-17-6; GlcNAc; N-ACETYL-D-GLUCOSAMINE; N-acetyl-beta-D-glucosamine; N-acetylglucosamine; NAcGlc

948887-87-4

98632-70-3

A0092

A2278_SIGMA

A8176_SIGMA

AC-11093

AC-19960

AC1L1A9Z

AC1L2N8G

AC1L335S

AC1L96TK

AC1L9HNX

AC1Q5JMQ

AC1Q5JMS

AC1Q5M0I

acetylglucosamine

Aflexa

AI3-51898

AR-1J1882

AR-1K5743

Beta-N-Acetylglucosamine

bmse000231

BSPBio_003020

C00140

C02711

C03878

C03878; N-Acetyl-beta-D-glucosamine

CHEBI:13962; CHEBI:23099; CHEBI:3596

CHEBI:27425

CHEBI:28009

CHEBI:44166; CHEBI:7169; CHEBI:21579; CHEBI:7140

CHEBI:44278

CHEBI:44280

CHEBI:506227

CHEMBL1234611

CHEMBL1234669

CHEMBL447878

chitin

CID24139

CID439174

CID445246

CID82313

CID899

CPD-12541

Crab Shell Chitin

D-Glucose, 2-(acetylamino)-2-deoxy-

D-Glucose, 2-acetamido-2-deoxy-

DAP000872

DB00141

DivK1c_000352

EINECS 231-368-2

EINECS 233-115-1

GlcNAc

Glucosamine Complex

Glucosamine, N-acetyl

GS-500

hexopyranose, 2-(acetylamino)-2-deoxy-

HMS1921E22

HMS501B14

hydrolyzed chitin

IDI1_000352

JFD00446

KBio1_000352

KBio2_001479

KBio2_004047

KBio2_006615

KBio3_002240

KBioGR_001817

KBioSS_001479

L001205

LS-183152

Maxi GS

MFCD00061615

MFCD00136044

MLS001333127

MLS001333128

MLS001333153

MLS001333154

MolPort-000-146-208

MolPort-001-769-950

MolPort-002-903-801

MolPort-003-666-324

MolPort-003-871-954

N-((3R,4R,5R,6R)-2,4,5-Trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)acetamide

N-Acetyl-alpha-D-glucosamine

N-acetyl-alpha-D-glucosaminides

n-acetyl-b-d-glucosamine

N-Acetyl-beta-D-glucosamine

N-Acetyl-D-Allosamine

N-Acetyl-D-galactosamine

N-Acetyl-D-glucosamine, 98+%

N-Acetyl-D-glucosamine-Agarose

N-Acetyl-D-hexosamine

N-acetyl-D-mannosamine

N-Acetylchitosamine

N-Acetylchondrosamine

N-Acetylgalactosamine

N-acetylglucosamine

N-Acetylhexosamine

N-[(2R,3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide

N-[(2R,3R,4S,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide

N-[(2S,3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide

N-[(3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide

N-[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide

NAcGlc

Natures Blend Glucosamine

NCGC00178341-01

nchembio.151-comp5

nchembio.2007.41-comp2

nchembio.520-comp1

nchembio.96-comp2

NDG

NINDS_000352

NSC 400525

NSC 524344

pharmaceutical aid

SB01966

SMR000857242

SMR000857252

SPBio_001565

SPECTRUM1500715

Spectrum2_001353

Spectrum3_001400

Spectrum4_001179

Spectrum_000999

SR-01000634877-1

STOCK1N-72555

UNII-T13TI5GH3D

ZINC03860151

ZINC03983907

ZINC05883957

[4)-beta-D-GlcpNAc(1->]n; chitin

Download: MOL2 SDF SMILES Flexibase

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) -3.08 -9.06 -16.14 5 7 0 119 221.209 2 ↓

Vendor Notes

Note Type Comments Provided By
Mp [°C] 211 Acros Organics
Melting_Point 213? dec. Alfa-Aesar
Melting_Point 213° dec. Alfa-Aesar
UniProt Database Links 3XYN1_VIBSX; 3XYN2_VIBSX; 3XYN_ALCSP; AGI1_WHEAT; AGI2_WHEAT; AGI3_WHEAT; AGI_HORVU; AGI_ORYSI; AGI_ORYSJ; AGI_URTDI; ALG5_DROME; ALL12_BLOTA; ALP_HYPAT; AMP1A_LYMAR; AMP_AMACA; AMP_AMARE; AMP_IPONI; AMP_TRIKH; CB30_HYDMC; CBLE_VISAL; CBP3_MOROL; CDA1_SCH ChEBI
UniProt Database Links 41_CANFA; 41_HUMAN; 41_MOUSE; A1AT_MACEU; A4GCT_HUMAN; ABL_AGABI; ACMA_LACLA; ACMA_LACLC; ACMA_LACLM; ADF1_DROME; AGI1_WHEAT; AGI2_WHEAT; AGI3_WHEAT; AGI_ORYSI; AGI_ORYSJ; AGI_URTDI; AGM1_ARATH; AGM1_CANAX; AGM1_ENCCU; AGM1_HUMAN; AGM1_MOUSE; AGM1_ORYSJ ChEBI
Purity 97% APIChem
UniProt Database Links A4GCT_HUMAN; ACMA_LACLA; ACMA_LACLC; ACMA_LACLM; AG10A_HUMAN; AG10B_HUMAN; AG10B_MOUSE; AG10B_RAT; AGI1_WHEAT; AGI2_WHEAT; AGI3_WHEAT; AGI_ORYSI; AGI_ORYSJ; AGI_URTDI; AGM1_ARATH; AGM1_CANAX; AGM1_ENCCU; AGM1_HUMAN; AGM1_MOUSE; AGM1_ORYSJ; AGM1_SCHPO; AGM ChEBI
Therapy antiarthritic SMDC MicroSource
Patent Database Links EP1234514; EP1266664; EP1466631; EP1498128; EP1516882; EP1529536; EP1559433; EP1574217; EP1589036; EP1598066; EP1602334; EP1607095; EP1611877; EP1616570; EP1632242; EP1647269; EP1656944; EP1669462; EP1674078; EP1679077; EP1685847; EP1704878; EP1731134; EP ChEBI
Reactome Database Links REACT_163715; REACT_163747; REACT_163758; REACT_7959; REACT_7965; REACT_8002 ChEBI
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics
PUBCHEM_PATENT_ID US5731293 IBM Patent Data

Activity (Go SEA)

Direct Reactome Annotations (via ChEBI)

Description Species
Ficolins bind to repetitive carbohydrate structures on the target cell surface
Initial triggering of complement
Lectin pathway of complement activation

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