Chemical Compound

J3.557.306B

J3.557.306B chemical structure
Primary Record

J3.557.306B

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
177556750
SMILES
CC1C(C(CC(O1)OC2C(C(C(OC2OC3=C4C=C5C=C3OC6=C(C=C(C=C6)C(C(C(=O)NC(C(=O)NC5C(=O)NC7C8=CC(=C(C=C8)O)C9=C(C=C(C=C9O)O)C(NC(=O)C(C(C1=CC(=C(O4)C=C1)Cl)O)NC7=O)C(=O)O)CC(=O)N)NC(=O)C(CC(C)C)NC)O)Cl)CO)O)O)(C)NC(=O)C1=CC=C(C=C1)C1=NC2=C3C(=C1C)C=CC1=C(C(=NC(=C13)C=C2)C1=CC=C(C=C1)C(=O)NC1(CC(OC(C1O)C)OC1C(C(C(OC1OC1=C2C=C3C=C1OC1=C(C=C(C=C1)C(C(C(=O)NC(C(=O)NC3C(=O)NC1C3=CC(=C(C=C3)O)C3=C(C=C(C=C3O)O)C(NC(=O)C(C(C3=CC(=C(O2)C=C3)Cl)O)NC1=O)C(=O)O)CC(=O)N)NC(=O)C(CC(C)C)NC)O)Cl)CO)O)O)C)C)O
Canonical SMILES
CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)O)c4cc(O)cc(O)c4-c4cc3ccc4O)C(O)c3ccc(c(Cl)c3)Oc3cc2cc(c3OC2OC(CO)C(O)C(O)C2OC2CC(C)(NC(=O)c3ccc(-c4nc5ccc6nc(-c7ccc(C(=O)NC8(C)CC(OC9C(Oc%10c%11cc%12cc%10Oc%10ccc(cc%10Cl)C(O)C%10NC(=O)C(NC(=O)C%12NC(=O)C(CC(N)=O)NC(=O)C(NC(=O)C(CC(C)C)NC)C(O)c%12ccc(c(Cl)c%12)O%11)c%11ccc(O)c(c%11)-c%11c(O)cc(O)cc%11C(C(=O)O)NC%10=O)OC(CO)C(O)C9O)OC(C)C8O)cc7)c(C)c7ccc(c4C)c5c67)cc3)C(O)C(C)O2)Oc2ccc(cc2Cl)C1O

Names & Synonyms

  • J3.557.306B
  • 3,6-Dimethyl-2,7-bis[4-[(vancomycin-3 -N-yl)carbonyl]phenyl]-1,8-diazapyrene
  • 22-(carbamoylmethyl)-48-[(3-{[4-(4-{13-[4-({6-[(2-{[22-(carbamoylmethyl)-40-carboxy-47,49-dichloro-2,18,32,35,37-pentahydroxy-19-[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-3,5,8,10,12(48),14,16,29,31,33(45),34,36,38,46,49-pentadecaen-48-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy]-3-hydroxy-2,4-dimethyloxan-4-yl}carbamoyl)phenyl]-7,12-dimethyl-5,14-diazatetracyclo[6.6.2.04,16.011,15]hexadeca-1,3,5,7,9,11,13,15-octaen-6-yl}benzamido)-5-hydroxy-4,6-dimethyloxan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-47,49-dichloro-2,18,32,35,37-pentahydroxy-19-[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),34,36,3