Chemical Compound

Desleucyl vancomycin

CAS Registry Number 115236-65-2
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Desleucyl vancomycin chemical structure
Primary Record

Desleucyl vancomycin

In stock
4,380 g
Purity
99.5 %
CAS
115236-65-2

Compound Identifiers & Properties

CAS
115236-65-2
PubChem CID
189282
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]7C(=O)N[C@@H](C8=C(C(=CC(=C8)O)O)C9=C(C=CC(=C9)[C@H](C(=O)N7)NC(=O)[C@@H]5NC(=O)[C@@H](NC(=O)[C@@H]([C@@H](C1=CC(=C(O4)C=C1)Cl)O)N)CC(=O)N)O)C(=O)O)O)Cl)CO)O)O)(C)N)O
Canonical SMILES
C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3c4cc5cc3Oc3ccc(cc3Cl)[C@@H](O)[C@@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H]5C(=O)N[C@H]3C(=O)N[C@H](C(=O)N[C@H](C(=O)O)c5cc(O)cc(O)c5-c5cc3ccc5O)[C@H](O)c3ccc(c(Cl)c3)O4)O[C@H](CO)[C@@H](O)[C@@H]2O)C[C@](C)(N)[C@@H]1O

Names & Synonyms

  • Desleucyl vancomycin
  • Vancomycin hexapeptide
  • AC1L4OEL
  • AC1Q5QX8
  • KST-1A1103
  • AR-1A1460
  • ARD170144
  • CID189282
  • 115236-65-2
  • (1S,2R,18R,19R,22S,25R,28R,40S)-19-Amino-48-[(2S,3R,4S,5S,6R)-3-[(2S,4S,5S,6S)-4-amino-5-hydroxy-4,6-dimethyloxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-22-(2-amino-2-oxoethyl)-5,15-dichloro-2,18,32,35,37-pentahydroxy-20,23,26,42,44-pentaoxo-7,13-dioxa-21,24,27,41,43-pentazaoctacyclo[26.14.2.23,6.214,17.18,12.129,33.010,25.034,39]pentaconta-3,5,8,10,12(48),14,16,29(45),30,32,34(39),35,37,46,49-pentadecaene-40-carboxylic acid
  • 1H-Benzimidazole-2-sulfonamide, 6-nitro-N,N,1-triethyl-
  • Vancomycin, 49-de(4-methyl-2-(methylamino)-1-oxopentyl)-
  • (1s,2r,18r,19r,22s,25r,28r,40s)-19-amino-48-{[(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}-22-(2-amino-2-oxoethyl)-5,15-dichloro-2,18,32,35,37-pentahydroxy-20,23,26,42,44-pentaoxo-7,13-dioxa-21,24,27,41,43-pentaazaoctacyclo[26.14.2.23,6.214,17.18,12.129,33.010,25.034,39]pentaconta-3,5,8(48),9,11,14,16,29(45),30,32,34,36,38,46,49-pentadecaene-40-carboxylic acid(non-preferred name)
  • 13254-07-4
  • Vancomycin Hexapeptide; Vancomycin, 49-de[4-methyl-2-(methylamino)-1-oxopentyl]- (9CI)