Chemical Compound

Vancomycin HCL

CAS Registry Number 2416251-24-4
Vancomycin HCL chemical structure
Primary Record

Vancomycin HCL

In stock
3,966 g
Purity
99.5 %
CAS
2416251-24-4

Compound Identifiers & Properties

CAS
2416251-24-4
PubChem CID
6917992
SMILES
C[C@H]1[C@H]([C@@](C[C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2OC3=C4C=C5C=C3OC6=C(C=C(C=C6)[C@H]([C@H](C(=O)N[C@H](C(=O)N[C@H]5C(=O)N[C@@H]7C8=CC(=C(C=C8)O)C9=C(C=C(C=C9O)O)[C@@H](NC(=O)[C@H]([C@@H](C1=CC(=C(O4)C=C1)Cl)O)NC7=O)C(=O)O)CC(=O)N)NC(=O)[C@@H](CC(C)C)NC)O)Cl)CO)O)O)(C)N)O
Canonical SMILES
CN[C@H](CC(C)C)C(=O)N[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H]2C(=O)N[C@H]3C(=O)N[C@H](C(=O)N[C@@H](C(=O)O)c4cc(O)cc(O)c4-c4cc3ccc4O)[C@H](O)c3ccc(c(Cl)c3)Oc3cc2cc(c3O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@H]2C[C@](C)(N)[C@H](O)[C@H](C)O2)Oc2ccc(cc2Cl)[C@H]1O

Names & Synonyms

  • Vancomycin HCL
  • Vancomycin Impurity J
  • Vancomycin EP Impurity J
  • VANCOMYCIN
  • 26-epi-Vancomycin B
  • Cyclodextrin-benzaldehyde
  • SCHEMBL52079
  • BIDD:GT0353
  • (RS6) (C alpha,7R) Vancomycin B
  • CID6917992
  • 2416251-24-4
  • B1370-425968
  • N0001-018247
  • (3S,6R,7R,22R,23S,26R,36R,38aR)-3-(2-amino-2-oxoethyl)-44-(((2S,3R,4S,5S,6R)-3-(((2S,4S,5S,6S)-4-amino-5-hydroxy-4,6-dimethyltetrahydro-2H-pyran-2-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-19,45-dichloro-7,22,28,30,32-pentahydroxy-6-((R)-4-methyl-2-(methylamino)pentanamido)-2,5,24,38,39-pentaoxo-2,3,4,5,6,7,23,24,25,26,36,37,38,38a-tetradecahydro-1H,22H-23,36-(epiminomethano)-8,11:18,21-dietheno-13,16:31,35-di(metheno)benzo[n][1]oxa[6,9]diazacyclohexadecino[4,5-d][1]oxa[7,17]diazacyclotetracosine-26-carboxylic acid
  • 1404-90-6
  • 1404-93-9