Chemical Compound

J2.170.708B

J2.170.708B chemical structure
Primary Record

J2.170.708B

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
102573531
SMILES
CC(C)C[C@H](C(=O)N[C@@H]1[C@@H](C2=CC(=C(C=C2)OC3=CC4=CC(=C3O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CN6C=C(N=N6)C(=O)O)O)O)O)OC7=C(C=C(C=C7)[C@H]([C@H]8C(=O)N[C@@H](C9=C(C(=CC(=C9)O)O)C2=C(C=CC(=C2)[C@H](C(=O)N8)NC(=O)[C@@H]4NC(=O)[C@@H](NC1=O)CC(=O)N)O)C(=O)O)O)Cl)Cl)O)NC
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](Cn3cc(C(=O)O)nn3)[C@@H](O)[C@H](O)[C@H]2O)Oc2ccc(cc2Cl)[C@H]1O

Names & Synonyms

  • J2.170.708B
  • (1S,2R,18R,19R,22S,25R,28R,40S)-22-(carbamoylmethyl)-48-{[(2S,3R,4S,5S,6R)-6-[(4-carboxy-1H-1,2,3-triazol-1-yl)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-47,49-dichloro-2,18,32,35,37-pentahydroxy-19-[(2R)-4-methyl-2-(methylamino)pentanamido]-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),9,11,14,16,29,31,33(45),34,36,38,46,49-pentadecaene-40-carboxylic acid
  • 6 -(4-Carboxy-1H-1,2,3-triazole-1-yl)-6 -deoxy-2 -O-des(3-amino-3-methyl-2,3,6-trideoxy-L-lyxo-hexopyranosyl)vancomycin