Fulvestrant

Basic Information

CAS ID: 129453-61-8
Molecular Formula: C32H47F5O3S
Molecular Weight: 606.8 g/mol
Monoisotopic Mass: 606.3166 g/mol
Class: Small Molecule
Natural Product: No
Other Names: ICI 182,780 | Faslodex | FULVESTRANT | ZD9238
Analysis: Drug repositioning mechanism analysis

S+ O- F F F F F OH OH

Compound Structure and Identifier

InChI: InChI=1S/C32H47F5O3S/c1-30-17-15-26-25-12-11-24(38)21-23(25)20-22(29(26)27(30)13-14-28(30)39)10-7-5-3-2-4-6-8-18-41(40)19-9-16-31(33,34)32(35,36)37/h11-12,21-22,26-29,38-39H,2-10,13-20H2,1H3/t22-,26-,27+,28+,29-,30+,41?/m1/s1 See All
InChI Key: VWUXBMIQPBEWFH-WCCTWKNTSA-N
Smiles: C[C@]12CC[C@H]3[C@@H]([C@H](CCCCCCCCC[S+]([O-])CCCC(F)(F)C(F)(F)F)Cc4cc(O)ccc34)[C@@H]1CC[C@@H]2O See All
Molfile: Download

Related Target

Target ID Name Interaction
T0538 Estrogen receptor inhibitor

Related Fibrosis Property

Reference Record 1

PubMed ID 27025157 Target ID T0538
Uniprot ID Estrogen receptor Name Estrogen receptor
Model vitro,rat Fibrosis Disease Cardiac fibrosis
Process I
Process II fibroblasts proliferation
Process III prevenet collagen deposition
Mechanism Targeting ERK1/2

Related Link

PubChem: 104741
ChEMBL: CHEMBL1358