Chemical Compound

CHEMBL1288739

CHEMBL1288739 chemical structure
Primary Record

CHEMBL1288739

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
52940848
SMILES
CCN\1C2=C(C3=C(C=C2)C(=CC(=C3)S(=O)(=O)O)S(=O)(=O)O)C(/C1=C\C=C\C=C\C4=[N+](C5=C(C4(C)C)C6=C(C=C5)C(=CC(=C6)S(=O)(=O)O)S(=O)(=O)O)CCCCCC(=O)N[C@@H](CCC(=O)N[C@@H](COP(=O)([O-])O[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)(C)C
Canonical SMILES
CCN1/C(=C/C=C/C=C/C2=[N+](CCCCCC(=O)N[C@@H](CCC(=O)N[C@@H](COP(=O)([O-])O[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)c3ccc4c(S(=O)(=O)O)cc(S(=O)(=O)O)cc4c3C2(C)C)C(C)(C)c2c1ccc1c(S(=O)(=O)O)cc(S(=O)(=O)O)cc21

Names & Synonyms

  • CHEMBL1288739
  • BDBM50331103
  • (S)-2-carboxy-2-((S)-4-carboxy-4-(6-(2-(5-(3-ethyl-1,1-dimethyl-6,8-disulfo-1H-benzo[e]indol-2(3H)-ylidene)penta-1,3-dienyl)-1,1-dimethyl-6,8-disulfo-1H-benzo[e]indolium-3-yl)hexanamido)butanamido)ethyl (S)-1,3-dicarboxypropyl phosphate