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Prednisolone Sodium Phosphate

CAT: 0572-TRC-P703775-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-P703775-1GSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
125-02-0
Synonyms
Prednisolone Sodium Phosphate; Ak-pred; Codelsol; Disodium prednisolone 21-phosphate; Dojilon; Hefasolon; Hydeltrasol; Inflamase; Metreton; Optival; Orapred; Pediapred; Phortisolone; Prednesol; Prednisolone 21-(disodium phosphate); Prednisolone 21-phosphate disodium; Prednisolone 21-phosphate disodium salt; Prednisolone disodium phosphate; Prednisolone sodium phosphate; Predonema; Predsol; Predsolan; Prozorin; Sodium prednisolone phosphate; Solu-Predalone; Solucort; (11beta)-11,17-Dihydroxy-21-(phosphonooxy)pregna-1,4-diene-3,20-dione disodium salt; 11beta,17,21-Trihydroxypregna-1,4-diene-3,20-dione 21-(dihydrogen phosphate) disodium salt; 11beta,17,21-Trihydroxypregna-1,4-diene-3,20-dione 21-phosphate disodium salt
Hazard Statement
May damage fertility or the unborn child.
Purity
>95% (HPLC)
Smiles
[Na+].[Na+].C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CC[C@]2(O)C(=O)COP(=O)([O-])[O-]
Molecular Formula
C21 H27 O8 P . 2 Na
Molecular Weight
484.39
InChI
InChI=1S/C21H29O8P.2Na/c1-19-7-5-13(22)9-12(19)3-4-14-15-6-8-21(25,17(24)11-29-30(26,27)28)20(15,2)10-16(23)18(14)19;;/h5,7,9,14-16,18,23,25H,3-4,6,8,10-11H2,1-2H3,(H2,26,27,28);;/q;2*+1/p-2/t14-,15-,16-,18+,19-,20-,21-;;/m0../s1
Additionnal Information
IUPAC name: disodium;[2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] phosphate
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Prednisolone Sodium Phosphate

Prednisolone sodium phosphate can cause developmental toxicity according to state or federal government labeling requirements.

CAS Number125-02-0
PubChem CID441409
IUPAC Namedisodium;[2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] phosphate
Molecular FormulaC21H27Na2O8P
Molecular Weight484.4
Topological Polar Surface Area147
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Heavy Atom Count32
Formal Charge0
Complexity878
SMILES
C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1CC[C@@]2(C(=O)COP(=O)([O-])[O-])O)CCC4=CC(=O)C=C[C@]34C)O.[Na+].[Na+]
InChI
InChI=1S/C21H29O8P.2Na/c1-19-7-5-13(22)9-12(19)3-4-14-15-6-8-21(25,17(24)11-29-30(26,27)28)20(15,2)10-16(23)18(14)19;;/h5,7,9,14-16,18,23,25H,3-4,6,8,10-11H2,1-2H3,(H2,26,27,28);;/q;2*+1/p-2/t14-,15-,16-,18+,19-,20-,21-;;/m0../s1
InChIKey
VJZLQIPZNBPASX-OJJGEMKLSA-L
Chemical Structure
2D Structure
2D structure of Prednisolone Sodium Phosphate
CAS: 125-02-0
CID: 441409
Formula: C21H27Na2O8P
MW: 484.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight484.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Exact Mass484.12389338
Monoisotopic Mass484.12389338
Topological Polar Surface Area147 Ų
Heavy Atom Count32
Formal Charge0
Complexity878
Isotope Atom Count0
Defined Atom Stereocenter Count7
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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