PU-H71

Basic Information

CAS ID: 873436-91-0
Molecular Formula: C18H21IN6O2S
Molecular Weight: 512.4 g/mol
Monoisotopic Mass: 512.0491 g/mol
Class: Small Molecule
Natural Product: No
Other Names:
Analysis: Drug repositioning mechanism analysis

NH N S O O I N NH2 N N

Compound Structure and Identifier

InChI: InChI=1S/C18H21IN6O2S/c1-10(2)21-4-3-5-25-17-15(16(20)22-8-23-17)24-18(25)28-14-7-13-12(6-11(14)19)26-9-27-13/h6-8,10,21H,3-5,9H2,1-2H3,(H2,20,22,23) See All
InChI Key: SUPVGFZUWFMATN-UHFFFAOYSA-N
Smiles: CC(C)NCCCn1c(Sc2cc3OCOc3cc2I)nc4c(N)ncnc14 See All
Molfile: Download

Related Target

Target ID Name Interaction
T0955 Heat shock protein 90 inhibitor

Related Fibrosis Property

Reference Record 1

PubMed ID 24470592 Target ID T0955
Uniprot ID Heat shock protein 90 Name Heat shock protein 90
Model human,mice Fibrosis Disease Bone marrow fibrosis
Process I
Process II
Process III prevenet collagen deposition
Mechanism

Related Link

PubChem: 9549213
ChEMBL: CHEMBL200102