UCSF

ZINC02077807

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 15 No

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

Find On: PubMed — Wikipedia — Google

CAS Numbers: 14215-68-0 , 1811-31-0 , 3615-17-6 , 7512-17-6

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) -3.08 -7.88 -17.31 5 7 0 127 221.209 6 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 1.48e+02 g/l DrugBank-nutriceuticals
ALOGPS_SOLUBILITY 2.54e+02 g/l DrugBank-nutriceuticals
Melting_Point 213? dec. Alfa-Aesar
Melting_Point 213° dec. Alfa-Aesar
Purity 95% Fluorochem
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
Patent Database Links EP1516881; EP1535620; EP1538166; EP1609473; EP1611894; EP1611895; EP1611896; EP1666046; EP1669076; EP1669077; EP1731132; EP1749532; EP1844784; EP1995306; EP1995323; US2007178161; US2007191291; US2007196292; US2007197470; US2007207198; US2007248556; US2007 ChEBI
Notes From synthetic source Apollo Scientific Bioactives
Reactome Database Links REACT_120723; REACT_120758; REACT_121018; REACT_121200; REACT_163764 ChEBI

Activity (Go SEA)

Direct Reactome Annotations (via ChEBI)

Description Species
HS-GAG degradation
Hyaluronan uptake and degradation
Scavenging by Class A Receptors

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