GR1

6-CARBAMIMIDOYL-2-[5-(3-DIETHYLCARBAMOYL-PHENYL)-2-HYDROXY-INDAN-1-YL]-HEXANOIC ACID



Chemical Component Summary

Name6-CARBAMIMIDOYL-2-[5-(3-DIETHYLCARBAMOYL-PHENYL)-2-HYDROXY-INDAN-1-YL]-HEXANOIC ACID
SynonymsGR179849
Identifiers(2R)-7-amino-2-[(1S,2S)-5-[3-(diethylcarbamoyl)phenyl]-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-7-imino-heptanoic acid
FormulaC27 H35 N3 O4
Molecular Weight465.585
TypeNON-POLYMER
Isomeric SMILESCCN(CC)C(=O)c1cccc(c1)c2ccc3c(c2)C[C@@H]([C@H]3[C@@H](CCCCC(=N)N)C(=O)O)O
InChIInChI=1S/C27H35N3O4/c1-3-30(4-2)26(32)19-9-7-8-17(14-19)18-12-13-21-20(15-18)16-23(31)25(21)22(27(33)34)10-5-6-11-24(28)29/h7-9,12-15,22-23,25,31H,3-6,10-11,16H2,1-2H3,(H3,28,29)(H,33,34)/t22-,23+,25-/m1/s1
InChIKeyVACZRUKFUJTPNR-GIFXNVAJSA-N

Chemical Details

Formal Charge0
Atom Count69
Chiral Atom Count3
Bond Count71
Aromatic Bond Count13

Related Resource References

Resource NameReference
PubChem 448126