2-Hydroxy Estradiol 6-N3-Adenine

CAS: 912671-55-7

Ref. TR-H942160

Produktinformation

• Name: 2-Hydroxy Estradiol 6-N3-Adenine
• Synonyme: (17ß)-6-(6-Amino-3H-purin-3-yl)-estra-1,3,5(10)-triene-2,3,17-triol

Beschreibung

Applications 2-Hydroxy Estradiol 6-N3-Adenine is a depurinating adduct that is created by the interaction of specific metabolites of estrogens in the body with DNA. Unfortunately, these adducts are endogeneous initiators of various human cancers, such as breast & prostate.
References Yang, L., et al.: Prostate, 69, 41 (2009); Zahid, M., et al.: Chem. Res. Toxicol., 19, 164 (2006); Zhang, Y., et al.: Metabol. Clin. Exp., 56, 887 (2007)

• Marke: TRC

Chemische Eigenschaften

• Molekulargewicht: 421.49
• Formel: C₂₃H₂₇N₅O₃
• Farbe/Form: Neat
• InChl: InChI=1S/C23H27N5O3/c1-23-5-4-11-12-7-17(29)18(30)8-14(12)16(6-13(11)15(23)2-3-19(23)31)28-10-27-21(24)20-22(28)26-9-25-20/h7-11,13,15-16,19,29-31H,2-6,24H2,1H3/t11-,13-,15+,16?,19+,23+/m1/s1
• InChI Key: InChIKey=SKTXDUKLUKAABT-MIPWJFNXSA-N
• SMILES: C[C@]12CC[C@@H]3c4cc(O)c(O)cc4C(n4cnc(N)c5ncnc4-5)C[C@H]3[C@@H]1CC[C@@H]2O