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19-Nordeoxycorticosterone

CAT: 0572-TRC-N668010-5MGSize: 5 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-N668010-5MGSize:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
4682-70-6
Hazard Statement
Suspected of causing cancer
Purity
>95% (HPLC)
Smiles
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@@H]2C(=O)CO
Molecular Formula
C20 H28 O3
Molecular Weight
316.435
InChI
InChI=1S/C20H28O3/c1-20-9-8-15-14-5-3-13(22)10-12(14)2-4-16(15)17(20)6-7-18(20)19(23)11-21/h10,14-18,21H,2-9,11H2,1H3/t14-,15+,16+,17-,18+,20-/m0/s1
Additionnal Information
IUPAC name: (8R,9S,10R,13S,14S,17S)-17-(2-hydroxyacetyl)-13-methyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

19-Nordeoxycorticosterone

isolated from urine of castrated rats with regenerating adrenals

CAS Number4682-70-6
PubChem CID123947
IUPAC Name(8R,9S,10R,13S,14S,17S)-17-(2-hydroxyacetyl)-13-methyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one
Molecular FormulaC20H28O3
Molecular Weight316.4
XLogP2.3
Topological Polar Surface Area54.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count23
Formal Charge0
Complexity563
SMILES
C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)CO)CCC4=CC(=O)CC[C@H]34
InChI
InChI=1S/C20H28O3/c1-20-9-8-15-14-5-3-13(22)10-12(14)2-4-16(15)17(20)6-7-18(20)19(23)11-21/h10,14-18,21H,2-9,11H2,1H3/t14-,15+,16+,17-,18+,20-/m0/s1
InChIKey
YNCNEPHWJBSKJJ-OIHMHFBDSA-N
Chemical Structure
2D Structure
2D structure of 19-Nordeoxycorticosterone
CAS: 4682-70-6
CID: 123947
Formula: C20H28O3
MW: 316.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight316.4
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass316.20384475
Monoisotopic Mass316.20384475
Topological Polar Surface Area54.4 Ų
Heavy Atom Count23
Formal Charge0
Complexity563
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
412334-0119-Nordeoxycorticosterone
ARC0416KU-19-19
138560-AFKeratin 19 (K19, Keratin-19, CK-19, Cytokeratin-19)
138560-AF-FITCKeratin 19 (K19, Keratin-19, CK-19, Cytokeratin-19) (FITC)
138560-AF-BiotinKeratin 19 (K19, Keratin-19, CK-19, Cytokeratin-19) (Biotin)
138560-AF-APCKeratin 19 (K19, Keratin-19, CK-19, Cytokeratin-19) (APC)
138560-AF-PEKeratin 19 (K19, Keratin-19, CK-19, Cytokeratin-19) (PE)
138560-AF-HRPKeratin 19 (K19, Keratin-19, CK-19, Cytokeratin-19) (HRP)
228188Cytokeratin 19 (Keratin 19)
075-08PR-19 (1-19)

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