CHEBI:35419 - 26-hydroxycholesterol 3-sulfate

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ChEBI Name 26-hydroxycholesterol 3-sulfate
ChEBI ID CHEBI:35419
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C27H46O5S
Net Charge 0
Average Mass 482.71714
Monoisotopic Mass 482.30660
InChI InChI=1S/C27H46O5S/c1-18(17-28)6-5-7-19(2)23-10-11-24-22-9-8-20-16-21(32-33(29,30)31)12-14-26(20,3)25(22)13-15-27(23,24)4/h8,18-19,21-25,28H,5-7,9-17H2,1-4H3,(H,29,30,31)/t18?,19-,21+,22+,23-,24+,25+,26+,27-/m1/s1
InChIKey QCSROMOVNFYJNF-CCDZVGGQSA-N
SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OS(O)(=O)=O)[C@H](C)CCCC(C)CO
ChEBI Ontology
Outgoing 26-hydroxycholesterol 3-sulfate (CHEBI:35419) has functional parent 26-hydroxycholesterol (CHEBI:17703)
26-hydroxycholesterol 3-sulfate (CHEBI:35419) is a steroid sulfate (CHEBI:16158)
IUPAC Name
26-hydroxycholest-5-en-3β-yl hydrogen sulfate
Last Modified
26 March 2007