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CHEBI:94715 - sulfuric acid [(8R,9R,13S,14R)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ester

ChEBI IDCHEBI:94715
ChEBI Namesulfuric acid [(8R,9R,13S,14R)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ester
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DownloadsMolfile
FormulaC18H22O5S
Net Charge0
Average Mass350.436
Monoisotopic Mass350.11879
SMILESC[C@]12CC[C@H]3c4ccc(OS(=O)(=O)O)cc4CC[C@H]3[C@H]1CCC2=O
InChIInChI=1S/C18H22O5S/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19/h3,5,10,14-16H,2,4,6-9H2,1H3,(H,20,21,22)/t14-,15+,16+,18-/m0/s1
InChIKeyJKKFKPJIXZFSSB-LHHMISFZSA-N
ChEBI Ontology
Outgoing Relation(s)
sulfuric acid [(8R,9R,13S,14R)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ester (CHEBI:94715) is a steroid sulfate (CHEBI:16158)
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