53-34-9
FLUPREDNISOLONE
Name
FLUPREDNISOLONE
Formula
C21 H27 F O5
MolWeight
378.437
1Identification
【Name】
FLUPREDNISOLONE
【CAS】
【MDL】
MFCD00200355
【English Synonyms】
【Formula】
C21 H27 F O5
【MolWeight】
378.437
【Inchi】
InChI=1S/C21H27FO5/c1-19-5-3-11(24)7-14(19)15(22)8-12-13-4-6-21(27,17(26)10-23)20(13,2)9-16(25)18(12)19/h3,5,7,12-13,15-16,18,23,25,27H,4,6,8-10H2,1-2H3/t12-,13-,15-,16-,18+,19-,20-,21-/m0/s1
【InChIKey】
InChIKey=MYYIMZRZXIQBGI-HVIRSNARSA-N
【SMILES】
C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1CC[C@@]2(C(=O)CO)O)C[C@@H](C4=CC(=O)C=C[C@]34C)F)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
FLUPREDNISOLONE.cml
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