Search MNXref
SystemsX.ch
The Swiss Initiative in Systems Biology
 Feedback

11alpha-(fluoromethyl)-1alpha,25-dihydroxyvitamin D3 / 11alpha-(fluoromethyl)-1alpha,25-dihydroxycholecalciferol

PropertiesImageOccurences in reactions
MNX_IDMNXM33172Image of MNXM33172
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC28H45FO3
charge0
mass448.33527
referencelipidmapsM:LMST03020329
InChIKeyBYOKWYHYUFNMOU-UUKKMLSSSA-N
InChIInChI=1S/C28H45FO3/c1-18(7-6-12-27(3,4)32)24-10-11-25-22(13-20(17-29)16-28(24,25)5)9-8-21-14-23(30)15-26(31)19(21)2/h8-9,18,20,23-26,30-32H,2,6-7,10-17H2,1,3-5H3/b21-8-,22-9+/t18-,20+,23-,24-,25+,26+,28-/m1/s1
SMILESC=C1/C(=C\C=C2/C[C@H](CF)C[C@@]3(C)[C@H]2CC[C@@H]3[C@H](C)CCCC(C)(C)O)C[C@@H](O)C[C@@H]1O
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
lipidmaps:LMST03020329
lipidmapsM:LMST03020329 		11alpha-(fluoromethyl)-1alpha,25-dihydroxyvitamin D3 / 11alpha-(fluoromethyl)-1alpha,25-dihydroxycholecalciferol
(5Z,7E)-(1S,3R,11S)-11-(fluoromethyl)-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol