For research use only. Not for therapeutic Use.
NNC45-0781 is a tissue-selective estrogen partial-agonist.
| Catalog Number | I013314 |
| CAS Number | 207277-66-5 |
| Molecular Formula | C₂₇H₂₉NO₃ |
| Purity | ≥95% |
| Target | Estrogen Receptor/ERR |
| Solubility | DMSO |
| IUPAC Name | (3S,4R)-3-phenyl-4-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3,4-dihydro-2H-chromen-7-ol |
| InChI | InChI=1S/C27H29NO3/c29-22-10-13-24-26(18-22)31-19-25(20-6-2-1-3-7-20)27(24)21-8-11-23(12-9-21)30-17-16-28-14-4-5-15-28/h1-3,6-13,18,25,27,29H,4-5,14-17,19H2/t25-,27-/m1/s1 |
| InChIKey | FEVZKAOFFCUDLI-XNMGPUDCSA-N |
| SMILES | C1CCN(C1)CCOC2=CC=C(C=C2)C3C(COC4=C3C=CC(=C4)O)C5=CC=CC=C5 |
| Reference | [1]. Bury PS, et al. Synthesis and pharmacological evaluation of novel cis-3,4-diaryl-hydroxychromanes as high affinity partial agonists for the estrogen receptor. Bioorg Med Chem. 2002 Jan;10(1):125-45. |
