Home Other Building Blocks 1,3,5(10)-Estratrien-3,4,17beta-triol 4-methyl ether

1,3,5(10)-Estratrien-3,4,17beta-triol 4-methyl ether

CAS No.:
26788-23-8
Catalog Number:
AG00C1Q4
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00C1Q4
Chemical Name:
1,3,5(10)-Estratrien-3,4,17beta-triol 4-methyl ether
CAS Number:
26788-23-8
MDL Number:
MFCD00271573
IUPAC Name:
(8R,9S,13S,14S,17S)-4-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
InChI:
InChI=1S/C19H26O3/c1-19-10-9-12-11-5-7-16(20)18(22-2)14(11)4-3-13(12)15(19)6-8-17(19)21/h5,7,12-13,15,17,20-21H,3-4,6,8-10H2,1-2H3/t12-,13-,15+,17+,19+/m1/s1
InChI Key:
BCWZIZLVBYHFES-PYEWSWHRSA-N
Properties
Complexity:
425  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
5  
Defined Bond Stereocenter Count:
0
Exact Mass:
302.188g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
302.414g/mol
Monoisotopic Mass:
302.188g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Literature
Title Journal
Catechol-O-methyltransferase-mediated metabolism of 4-hydroxyestradiol inhibits the growth of human renal cancer cells through the apoptotic pathway. Carcinogenesis 20120201
Dietary quercetin exacerbates the development of estrogen-induced breast tumors in female ACI rats. Toxicology and applied pharmacology 20100901
A methoxyflavonoid, chrysoeriol, selectively inhibits the formation of a carcinogenic estrogen metabolite in MCF-7 breast cancer cells. The Journal of steroid biochemistry and molecular biology 20100101
Inhibitory effects of nitrative stress on the sulfation of 17β-estradiol and 4-methoxyestradiol by human MCF 10A mammary epithelial cells. Biological & pharmaceutical bulletin 20100101
Catechol-o-methyltransferase and methoxyestradiols participate in the intraoviductal nongenomic pathway through which estradiol accelerates egg transport in cycling rats. Biology of reproduction 20071201
4-Methoxyestradiol-induced oxidative injuries in human lung epithelial cells. Toxicology and applied pharmacology 20070501
A comparative study on the effects of 2,3,7,8,-tetrachlorodibenzo-p-dioxin polychlorinated biphenyl126 and estrogen in human bronchial epithelial cells. Toxicology and applied pharmacology 20040215
Effects of several dioxin-like compounds on estrogen metabolism in the malignant MCF-7 and nontumorigenic MCF-10A human mammary epithelial cell lines. Toxicology and applied pharmacology 20030801
Methoxyestrogens exert feedback inhibition on cytochrome P450 1A1 and 1B1. Cancer research 20030615
Selective synthesis of 4-methoxyestrogen from 4-hydroxyestrogen. Steroids 20010801
12-O-tetradecanoylphorbol-13-acetate upregulates the Ah receptor and differentially alters CYP1B1 and CYP1A1 expression in MCF-7 breast cancer cells. Journal of cellular biochemistry 19980901
Properties