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A-75943

CAT: 0013-GTR19210007-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19210007-03Size:100 mg
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Description
A-75943 is a small molecule inhibitor of bone resorption, originally isolated from Streptomyces. It is used in research to study osteoclast function and bone metabolism, with applications in both in vitro cell-based assays and in vivo models of osteoporosis.
CAS Number
201215-10-3
Smiles
O=C1[C@] ([C@]2 (C[C@@H] (CC (N) =O) CC (=O) O2) [H]) (C[C@@H] (C) C[C@@H]1C) [H]
Molecular Formula
C15H23NO4
Molecular Weight
281.35
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

A-75943

a bone resorption inhibitor from streptomyces; structure in first source

CAS Number201215-10-3
PubChem CID9925726
IUPAC Name2-[(2R,4S)-2-[(1S,3S,5S)-3,5-dimethyl-2-oxocyclohexyl]-6-oxooxan-4-yl]acetamide
Molecular FormulaC15H23NO4
Molecular Weight281.35
XLogP0.9
Topological Polar Surface Area86.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count20
Formal Charge0
Complexity420
SMILES
C[C@H]1C[C@@H](C(=O)[C@@H](C1)[C@H]2C[C@H](CC(=O)O2)CC(=O)N)C
InChI
InChI=1S/C15H23NO4/c1-8-3-9(2)15(19)11(4-8)12-5-10(6-13(16)17)7-14(18)20-12/h8-12H,3-7H2,1-2H3,(H2,16,17)/t8-,9-,10-,11-,12+/m0/s1
InChIKey
SAVFIMRLAWCZGX-UHFZAUJKSA-N
Chemical Structure
2D Structure
2D structure of A-75943
CAS: 201215-10-3
CID: 9925726
Formula: C15H23NO4
MW: 281.35
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight281.35
XLogP30.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass281.16270821
Monoisotopic Mass281.16270821
Topological Polar Surface Area86.5 Ų
Heavy Atom Count20
Formal Charge0
Complexity420
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS5812539A-75943

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