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Prednisolone disodium phosphate

CAT: 1568-C11498-100mgSize: 100 mgDry Ice: NoHazardous: No
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CAT#:1568-C11498-100mgSize:100 mg
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CAS Number
125-02-0
Synonyms
Hydeltrasol, Prednisolone 21-phosphate disodium
Target
Anti-infection
Applications
Microbiology
Smiles
[Na+].[Na+].CC12CC (O) C3C (CCC4=CC (=O) C=CC34C) C1CCC2 (O) C (=O) CO[P] ([O-]) ([O-]) =O
Molecular Formula
C21H27Na2O8P
Additionnal Information
Prednisolone disodium phosphate (Hydeltrasol, Prednisolone 21-phosphate disodium) is a synthetic glucocorticoid with anti-inflammatory and immunomodulating properties that exerts late mitogenic and biphasic effects on resistant acute lymphoblastic leukemia cells.
Storage Conditions
3 years -20°C powder

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...
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