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Hydroxyfluoroprednisolone butyrate

PropertiesImageOccurences in reactions
MNX_IDMNXM1374723Image of MNXM1374723
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC25H33FO7
charge0
mass464.53
referencehmdb:HMDB0061149
InChIKeyKODYJDILUXBYNG-MXHGPKCJSA-N
InChIInChI=1S/C25H33FO7/c1-4-5-21(32)33-24(20(31)13-27)9-7-15-16-11-18(29)17-10-14(28)6-8-22(17,2)25(16,26)19(30)12-23(15,24)3/h6,8,10,15-16,18-19,27,29-30H,4-5,7,9,11-13H2,1-3H3/t15-,16-,18-,19-,22-,23-,24-,25-/m0/s1
SMILES[CH3:1][CH2:4][CH2:5][C:21](=[O:32])[O:33][C@:24]1([C:20]([CH2:13][OH:27])=[O:31])[CH2:9][CH2:7][C@H:15]2[C@@H:16]3[CH2:11][C@H:18]([OH:29])[C:17]4=[CH:10][C:14](=[O:28])[CH:6]=[CH:8][C@:22]4([CH3:2])[C@@:25]3([F:26])[C@@H:19]([OH:30])[CH2:12][C@@:23]21[CH3:3]
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Similar chemical compounds in external resources
IdentifierDescription
hmdb:HMDB0061149 Hydroxyfluoroprednisolone butyrate
(1R,2S,8S,10S,11S,14R,15S,17S)-1-fluoro-8,17-dihydroxy-14-(2-hydroxyacetyl)-2,15-dimethyl-5-oxotetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-3,6-dien-14-yl butanoate
HFB
Hydroxyfluoroprednisolone butyric acid
hmdb:HMDB61149 secondary/obsolete/fantasy identifier