44-O-[2-O-[3-[4-(3,4-Dichlorophenoxymethyl)benzylamino]-3-methyl-2,3,6-trideoxy-L-lyxo-hexopyranosyl]-6-(trimethylaminio)-6-deoxy-beta-D-glucopyranosyl]-44-O-des[2-O-(3-amino-3-methyl-2,3,6-trideoxy-L-lyxo-hexopyranosyl)-beta-D-glucopyranosyl]vancomycin

化合物标识与属性

PubChem CID

101167131

SMILES

C[C@H]1[C@H]([C@@](CC(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(=N[C@H](C(=N[C@H]5C(=N[C@@H]7C8=CC(=C(C=C8)O)C9=C(C=C(C=C9O)O)[C@H](N=C([C@H]([C@@H](C1=CC(=C(O4)C=C1)Cl)O)N=C7O)O)C(=O)O)O)O)CC(=N)O)O)N=C([C@@H](CC(C)C)NC)O)O)Cl)C[N+](C)(C)C)O)O)(C)NCC1=CC=C(C=C1)COC1=CC(=C(C=C1)Cl)Cl)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](C[N+](C)(C)C)[C@@H](O)[C@H](O)[C@H]2OC2C[C@](C)(NCc3ccc(COc4ccc(Cl)c(Cl)c4)cc3)[C@H](O)[C@H](C)O2)Oc2ccc(cc2Cl)[C@H]1O