Ethisterone (CAS 434-03-7)

모습 :

Crystalline powder

건강 상태 :

Solid

용해도 :

Soluble in chloroform, DMSO (0.05 mg/ml), acetone (slightly ), ethanol (<1 mg/ml at 25° C), and water (<1 mg/ml at 25° C).

저장 :

Store at room temperature

녹는점 :

263-269° C (lit.)

비등점 :

~446.4° C at 760 mmHg (Predicted)

밀도 :

~1.1 g/cm³ (Predicted)

굴절률 :

n²⁰_D 1.57 (Predicted)

광학 활동 :

α20/D +31.5°±2.5°, c = 1 in Pyridine

IC50 :

Tyrosinase: IC₅₀ = 2.61 nM (Agaricus bisporus); Progesterone receptor: IC₅₀ = 59 nM (bovine); Androgen Receptor: IC₅₀ = 67 nM (rat); GR: IC₅₀ = 209 nM (human); Serotonin 2a : EC₅₀50 = 5.85 µM (mouse)

Ki 데이타 :

Progesterone receptor: K_i= 7.75 nM (bovine); Androgen Receptor: K_i= 44 nM (rat); GR: K_i= 95 nM (human)

pK 값 :

pK_a: 13.1 (Predicted)

WGK 독일 :

3

RTECS :

TU5570250

PubChem CID :

Merck 색인 :

14: 3741

MDL 번호 :

MFCD00003656

EC 번호 :

207-096-5

Beilstein 기재 :

1889895

SMILES :

C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]4(C#C)O)C