Structure

2-Methoxyestradiol

CAS
362-07-2
Catalog Number
ACM362072
Category
Inhibitors
Molecular Weight
302.41
Molecular Formula
C19H26O3

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Specification

Description
2-Methoxyestradiol (2-ME2), an orally active endogenous metabolite of 17β-estradiol (E2), is an apoptosis inducer and an angiogenesis inhibitor with potent antineoplastic activity. 2-Methoxyestradiol also destablize microtubules. 2-Methoxyestradio, also a potent superoxide dismutase (SOD) inhibitor and a ROS-generating agent, induces autophagy in the transformed cell line HEK293 and the cancer cell lines U87 and HeLa.
Synonyms
2-Me2
IUPAC Name
(8R,9S,13S,14S,17S)-2-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
Canonical SMILES
CC12CCC3C(C1CCC2O)CCC4=CC(=C(C=C34)OC)O
InChI Key
CQOQDQWUFQDJMK-SSTWWWIQSA-N
Boiling Point
464.4ºC at 760mmHg
Melting Point
188-190ºC
Flash Point
234.7ºC
Density
1.178g/cm³
Appearance
Off-white solid
Exact Mass
302.18800
Hazard Statements
T: Toxic;
Safety Description
22-26-36/37/39-45-53-36
WGK Germany
3
What is the molecular formula of 2-Methoxyestradiol?

The molecular formula of 2-Methoxyestradiol is C19H26O3.

What is the molecular weight of 2-Methoxyestradiol?

The molecular weight of 2-Methoxyestradiol is 302.4 g/mol.

What is the IUPAC name of 2-Methoxyestradiol?

The IUPAC name of 2-Methoxyestradiol is (8R,9S,13S,14S,17S)-2-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol.

What is the InChI of 2-Methoxyestradiol?

The InChI of 2-Methoxyestradiol is InChI=1S/C19H26O3/c1-19-8-7-12-13(15(19)5-6-18(19)21)4-3-11-9-16(20)17(22-2)10-14(11)12/h9-10,12-13,15,18,20-21H,3-8H2,1-2H3/t12-,13+,15-,18-,19-/m0/s1.

What is the InChIKey of 2-Methoxyestradiol?

The InChIKey of 2-Methoxyestradiol is CQOQDQWUFQDJMK-SSTWWWIQSA-N.

What is the Canonical SMILES of 2-Methoxyestradiol?

The Canonical SMILES of 2-Methoxyestradiol is CC12CCC3C(C1CCC2O)CCC4=CC(=C(C=C34)OC)O.

What is the CAS number of 2-Methoxyestradiol?

The CAS number of 2-Methoxyestradiol is 362-07-2.

What is the ChEMBL ID of 2-Methoxyestradiol?

The ChEMBL ID of 2-Methoxyestradiol is CHEMBL299613.

What is the UNII of 2-Methoxyestradiol?

The UNII of 2-Methoxyestradiol is 6I2QW73SR5.

What is the Wikipedia page for 2-Methoxyestradiol?

The Wikipedia page for 2-Methoxyestradiol is "2-Methoxyestradiol".

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