NRL972

Basic Information


CAS ID: 140616-46-2
Molecular Formula: C51H63N3O11S
Molecular Weight: 926.1 g/mol
Monoisotopic Mass: 925.4183 g/mol
Class: Small Molecule
Natural Product: No
Other Names: FLUORESCEIN LISICOL
Analysis: Drug repositioning mechanism analysis

O NH NH S NH O O OH O OH O HO OH OH HO


Compound Structure and Identifier


InChI: InChI=1S/C51H63N3O11S/c1-26(33-14-15-37-45-38(25-43(59)50(33,37)3)49(2)18-17-31(57)20-27(49)21-40(45)58)7-16-44(60)54-39(46(61)62)6-4-5-19-52-48(66)53-28-8-11-34-32(22-28)47(63)65-51(34)35-12-9-29(55)23-41(35)64-42-24-30(56)10-13-36(42)51/h8-13,22-24,26-27,31,33,37-40,43,45,55-59H,4-7,14-21,25H2,1-3H3,(H,54,60)(H,61,62)(H2,52,53,66)/t26-,27+,31-,33-,37+,38+,39+,40-,43+,45+,49+,50-/m1/s1 See All
InChI Key: KHNJPPGHIWPDLG-DXNXUNFASA-N
Smiles: C[C@H](CCC(=O)N[C@@H](CCCCNC(=S)Nc1ccc2c(c1)C(=O)OC23c4ccc(O)cc4Oc5cc(O)ccc35)C(=O)O)[C@H]6CC[C@H]7[C@@H]8[C@H](O)C[C@@H]9C[C@H](O)CC[C@]9(C)[C@H]8C[C@H](O)[C@]67C See All
Molfile: Download


Related Target



Related Fibrosis Property


Trial Record 1

ClinicalTrial ID NCT00896597 Disease Liver fibrosis
Phase Phase 1 Status Completed
First Received May 11, 2009 Last Verified August 9, 2010
Sponsor Norgine

Trial Record 2

ClinicalTrial ID NCT00856713 Disease Liver fibrosis
Phase Phase 1 Status Completed
First Received March 6, 2009 Last Verified March 6, 2009
Sponsor Norgine

Trial Record 3

ClinicalTrial ID NCT00794482 Disease Liver fibrosis
Phase Phase 3 Status Completed
First Received November 20, 2008 Last Verified October 8, 2009
Sponsor Norgine

Trial Record 4

ClinicalTrial ID NCT00856869 Disease Liver fibrosis
Phase Phase 1,Phase 2 Status Completed
First Received March 6, 2009 Last Verified March 6, 2009
Sponsor Norgine

Related Link


PubChem: 70697664
ChEMBL: CHEMBL2107751