Details of the Drug Metabolized by Drug-Metabolizing Enzyme (DME)

General Information of Drug (ID: DR2743)
Drug Name
Hyaluronic acid
Synonyms
Hyaluronic Acid [BAN]; Hylan G-F 20; Hyvisc; Luronit; Mucoitin; Amo Vitrax; Amvisc; Biolon; Etamucine; Sepracoat; Sofast; Synvisc; C33H54N2O23; EINECS 232-678-0; HSDB 7240; Hyaluronate Sodium (hyaluronic acid)
Indication Osteoarthritis [ICD11: FA00] Phase 4 [1]
Structure
3D MOL is unavailable 2D MOL
Pharmaceutical Properties Molecular Weight 846.8 Topological Polar Surface Area 400
Heavy Atom Count 58 Rotatable Bond Count 16
Hydrogen Bond Donor Count 14 Hydrogen Bond Acceptor Count 23
Cross-matching ID
PubChem CID
24847767
Formula
C33H54N2O23
Canonical SMILES
CC(=O)NC1C(C(C(OC1COCC2C(OC(C(C2O)(C)O)OCC3C(C(OC(C3O)CO)O)NC(=O)C)C(=O)O)CO)O)COC4C(C(C(C(O4)C(=O)O)O)O)O
InChI
1S/C33H54N2O23/c1-10(38)34-18-12(7-53-31-24(44)22(42)23(43)26(57-31)29(48)49)20(40)15(4-36)55-17(18)9-52-6-14-25(28(46)47)58-32(33(3,51)27(14)45)54-8-13-19(35-11(2)39)30(50)56-16(5-37)21(13)41/h12-27,30-32,36-37,40-45,50-51H,4-9H2,1-3H3,(H,34,38)(H,35,39)(H,46,47)(H,48,49)/t12-,13-,14+,15?,16?,17-,18?,19?,20-,21-,22+,23-,24?,25?,26?,27+,30+,31+,32+,33?/m0/s1
InChIKey
BVOZFCOTOYGLGD-VPQOAABJSA-N
The Predicted Metabolic Roadmap of This Drug
The Full List of Predicted Drug Metabolites (PDM) of This Drug
PDM Name PDM ID PubChem ID Reaction PDM Level Biosystem
Hyaluronic acid M1 PDM014490 N. A. Hydrolysis - Glycoside hydrolysis 1 Human
Hyaluronic acid M3 PDM014491 N. A. Conjugation - Sulfation of primary alcohol 1 Human
Hyaluronic acid M4 PDM014492 N. A. Conjugation - Sulfation of primary alcohol 1 Human
PNB-D-glucuronide M2 PDM007643
610
Hydrolysis - Glycoside hydrolysis 1 Human
Drug-Metabolizing Enzyme(s) (DME) Metabolizing This Drug
DME Name DME Info Species Uniprot ID EC Number REF
Hyaluronoglucosaminidase (nagH) DME1241 Treponema vincentii
NAGH_CLOPE
3.2.1.35
[2]
References
1 ClinicalTrials.gov (NCT00144820) Hyaluronan Versus NaCl 20 Ml Versus Placebo in Knee Osteoarthritis
2 An extracellular enzyme with hyaluronidase and chondroitinase activities from some oral anaerobic spirochaetes. Microbiology. 1996 Sep;142 ( Pt 9):2567-76.

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