Chemical Compound

J1.179.848I

J1.179.848I chemical structure
Primary Record

J1.179.848I

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
100949971
SMILES
C1=CC(=CC=C1C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)C(=O)O)C8=CC=C(C=C8)C(=O)O)C=C4)C9=CC=C(C=C9)C(=O)O)N3)C(=O)NCCCCNC(=O)C1=CC=C(C=C1)C1=C2C=CC(=C(C3=NC(=C(C4=CC=C(N4)C(=C4C=CC1=N4)C1=CC=C(C=C1)C(=O)O)C1=CC=C(C=C1)C(=O)O)C=C3)C1=CC=C(C=C1)C(=O)O)N2
Canonical SMILES
O=C(O)c1ccc(-c2c3nc(c(-c4ccc(C(=O)O)cc4)c4ccc([nH]4)c(-c4ccc(C(=O)NCCCCNC(=O)c5ccc(-c6c7nc(c(-c8ccc(C(=O)O)cc8)c8ccc([nH]8)c(-c8ccc(C(=O)O)cc8)c8nc(c(-c9ccc(C(=O)O)cc9)c9ccc6[nH]9)C=C8)C=C7)cc5)cc4)c4nc(c(-c5ccc(C(=O)O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1

Names & Synonyms

  • J1.179.848I
  • 4-[7,17-bis(4-carboxyphenyl)-12-(4-{[4-({4-[7,12,17-tris(4-carboxyphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]phenyl}formamido)butyl]carbamoyl}phenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]benzoic acid
  • N,N -(Butane-1,4-diyl)bis[4-[5,10,15-tris(4-carboxyphenyl)-21H,23H-porphyrin-20-yl]benzamide]