Drug General Information
Drug ID
D06HTI
Former ID
DNC000696
Drug Name
Glycopeptides
Drug Type
Small molecular drug
Indication Bacterial infections [ICD9: 001-009, 010-018, 020-027, 030-041, 080-088, 090-099, 100-104; ICD10:A00-B99] Investigative [538034]
Structure
Download
2D MOL

3D MOL

Formula
C20H32N6O12S2
Canonical SMILES
C(CC(=O)NC(CSSCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)C(=O)<br />NCC(=O)O)C(C(=O)O)N
InChI
1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/t9-,10-,11-,12-/m0/s1
InChIKey
YPZRWBKMTBYPTK-BJDJZHNGSA-N
CAS Number
CAS 27025-41-8
PubChem Compound ID
PubChem Substance ID
ChEBI ID
ChEBI:17858
SuperDrug ATC ID
V03AB32
SuperDrug CAS ID
cas=000070188
Target and Pathway
Target(s) D-alanine--D-alanine ligase Target Info Binder [538034]
KEGG Pathway D-Alanine metabolism
Peptidoglycan biosynthesis
Metabolic pathways
Vancomycin resistance
References
Ref 538034D-Ala-D-Ala ligases from glycopeptide antibiotic-producing organisms are highly homologous to the enterococcal vancomycin-resistance ligases VanA and VanB. Proc Natl Acad Sci U S A. 1997 Jun 10;94(12):6480-3.
Ref 538034D-Ala-D-Ala ligases from glycopeptide antibiotic-producing organisms are highly homologous to the enterococcal vancomycin-resistance ligases VanA and VanB. Proc Natl Acad Sci U S A. 1997 Jun 10;94(12):6480-3.

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