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Exemestane

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$54.99$59.99

Concentration
25 mg per mL
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This product is prepared for LABORATORY RESEARCH USE ONLY and may not be used for other purposes.

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Properties

Molecular Formula C20H24O2
Molecular Weight 296.4
Monoisotopic Mass 296.177630004
Polar Area 34.1
Complexity 653
XLogP 3.1
Heavy Atom Count 22
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Physical Appearance Clear Liquid
Stability Room Temperature
PubChem LCSS Exemestane Laboratory Chemical Safety Summary

Identifiers

CID 60198
CAS 107868-30-4
InChI InChI=1S/C20H24O2/c1-12-10-14-15-4-5-18(22)20(15, 3)9-7-16(14)19(2)8-6-13(21)11-17(12)19/h6, 8, 11, 14-16H, 1, 4-5, 7, 9-10H2, 2-3H3/t14-, 15-, 16-, 19+, 20-/m0/s1
InChIKey BFYIZQONLCFLEV-DAELLWKTSA-N
Isomeric SMILES C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CC(=C)C4=CC(=O)C=C[C@]34C
Canonical SMILES CC12CCC3C(C1CCC2=O)CC(=C)C4=CC(=O)C=CC34C
IUPAC Name (8R, 9S, 10R, 13S, 14S)-10, 13-dimethyl-6-methylidene-7, 8, 9, 11, 12, 14, 15, 16-octahydrocyclopenta[a]phenanthrene-3, 17-dione

2D Structure

Generated by Extreme Peptide with Open Babel, version 2.3.1, http://openbabel.org (accessed May 20, 2024)

Exemestane 2D molecular structure vector generated with oBabel

3D Structure

Interactive 3D representation of Exemestane (CID 60198)

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