CHEBI:137388 - (24S)-hydroxycholesterol 3-sulfate

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ChEBI Name (24S)-hydroxycholesterol 3-sulfate ChEBI ID CHEBI:137388 ChEBI ASCII Name (24S)-hydroxycholesterol 3-sulfate Definition A steroid sulfate that is (24S)-24-hydroxycholesterol carrying a single sulfo substituent at the O-3 position. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C27H46O5S Net Charge 0 Average Mass 482.718 Monoisotopic Mass 482.30660 InChI InChI=1S/C27H46O5S/c1-17(2)25(28)11-6-18(3)22-9-10-23-21-8-7-19-16-20(32-33(29,30)31)12-14-26(19,4)24(21)13-15-27(22,23)5/h7,17-18,20-25,28H,6,8-16H2,1-5H3,(H,29,30,31)/t18-,20+,21+,22-,23+,24+,25+,26+,27-/m1/s1 InChIKey UZRYBCGKNZOEMQ-XWXSNNQWSA-N SMILES [C@@]12([C@]3([C@](CC[C@@]1([C@@]4(C(C[C@H](CC4)OS(O)(=O)=O)=CC2)C)[H])([C@](CC3)([C@H](C)CC[C@@H](C(C)C)O)[H])C)[H])[H] ChEBI Ontology Outgoing (24S)-hydroxycholesterol 3-sulfate (CHEBI:137388) has functional parent (24S)-24-hydroxycholesterol (CHEBI:34310) (24S)-hydroxycholesterol 3-sulfate (CHEBI:137388) is a 24-hydroxy steroid (CHEBI:36865) (24S)-hydroxycholesterol 3-sulfate (CHEBI:137388) is a steroid sulfate (CHEBI:16158) (24S)-hydroxycholesterol 3-sulfate (CHEBI:137388) is conjugate acid of (24S)-hydroxycholesterol 3-sulfate(1−) (CHEBI:136567) Incoming (24S)-hydroxycholesterol 3-sulfate(1−) (CHEBI:136567) is conjugate base of (24S)-hydroxycholesterol 3-sulfate (CHEBI:137388) IUPAC Name (3β,24S)-24-hydroxycholest-5-en-3-yl hydrogen sulfate Synonym Source 24-OHChol-3-sulfate ChEBI Citation Type Source 19589875 PubMed citation Europe PMC Last Modified 09 June 2017