API0231593
Prednisolone Acetate
Prednicarbate is a topical corticosteroid.
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CAS No.
52-21-1
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Synonyms
prednisolone acetate; Omnipred; Econopred
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CHEMBL ID
CHEMBL1152
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Molecule Type
Small molecule
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Compound CID
5834
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Molecular Weight (g/mol)
402.5
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Molecular Formula
C23H30O6
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InChI
InChI=1S/C23H30O6/c1-13(24)29-12-19(27)23(28)9-7-17-16-5-4-14-10-15(25)6-8-21(14,2)20(16)18(26)11-22(17,23)3/h6,8,10,16-18,20,26,28H,4-5,7,9,11-12H2,1-3H3/t16-,17-,18-,20+,21-,22-,23-/m0/s1
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InChIKey
LRJOMUJRLNCICJ-JZYPGELDSA-N
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SMILES
CC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)C=C[C@]34C)O)C)O
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IUPAC Name
[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] acetate
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Exact Mass (Da)
402.20423867
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Monoisotopic Mass (Da)
402.20423867
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