(8R,9S,13S,14S)-3-Methoxy-13-methyl-7,8,9,11,12,13,15,16-octahydro-6H-cyclopenta[a]phenanthren-17(14H)-one-2-D - CAS 2122799-87-3
Catalog: |
BB016710 |
Product Name: |
(8R,9S,13S,14S)-3-Methoxy-13-methyl-7,8,9,11,12,13,15,16-octahydro-6H-cyclopenta[a]phenanthren-17(14H)-one-2-D |
CAS: |
2122799-87-3 |
Synonyms: |
3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one; 3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one |
IUPAC Name: | 3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one |
Description: | (8R,9S,13S,14S)-3-Methoxy-13-methyl-7,8,9,11,12,13,15,16-octahydro-6H-cyclopenta[a]phenanthren-17(14H)-one-2-D (CAS# 2122799-87-3 ) is a useful research chemical. |
Molecular Weight: | 285.40 |
Molecular Formula: | C19H23O2D |
Canonical SMILES: | CC12CCC3C(C1CCC2=O)CCC4=C3C=CC(=C4)OC |
InChI: | InChI=1S/C19H24O2/c1-19-10-9-15-14-6-4-13(21-2)11-12(14)3-5-16(15)17(19)7-8-18(19)20/h4,6,11,15-17H,3,5,7-10H2,1-2H3 |
InChI Key: | BCWWDWHFBMPLFQ-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
WO-2013012328-A1 | Process for the preparation of estetrol | 20110719 |
WO-2012051988-A2 | Derivatives of steroid benzylamines, having an antiparasitic, antibacterial, antimycotic and/or antiviral action | 20101006 |
US-2008076954-A1 | Ultrasound-induced destruction of trace-level estrogen hormones in aqueous solutions | 20060922 |
WO-2008039360-A2 | Ultrasound-induced destruction of trace-level estrogen hormones in aqueous solutions | 20060922 |
WO-2008039360-A9 | Ultrasound-induced destruction of trace-level estrogen hormones in aqueous solutions | 20060922 |
Complexity: | 431 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 284.177630004 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 284.177630004 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 4 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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