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CHEBI:68593 - eurysterol B(1−)

ChEBI IDCHEBI:68593
ChEBI Nameeurysterol B(1−)
Stars
ASCII Nameeurysterol B(1-)
DefinitionAn organosulfonate oxoanion obtained by the deprotonation of the sulfate group of eurysterol B hydrogen sulfate.
Last Modified3 October 2012
Submitternamrata
DownloadsMolfile
FormulaC27H43O7S
Net Charge-1
Average Mass511.701
Monoisotopic Mass511.27350
SMILES[H][C@@]12CC[C@]([H])([C@H](C)/C=C/CC(C)C)[C@@]1(C)CC[C@]1([H])[C@@]34CC[C@H](OS(=O)(=O)[O-])C[C@]3(O)[C@H](O)C[C@@]21OC4
InChIInChI=1S/C27H44O7S/c1-17(2)6-5-7-18(3)20-8-9-21-24(20,4)12-11-22-25-13-10-19(34-35(30,31)32)14-27(25,29)23(28)15-26(21,22)33-16-25/h5,7,17-23,28-29H,6,8-16H2,1-4H3,(H,30,31,32)/p-1/b7-5+/t18-,19+,20-,21-,22-,23-,24-,25+,26-,27+/m1/s1
InChIKeyQPVBWEUWNJWRLD-XPVUCKRVSA-M
ChEBI Ontology
Outgoing Relation(s)
eurysterol B(1−) (CHEBI:68593) is a organosulfate oxoanion (CHEBI:58958)
eurysterol B(1−) (CHEBI:68593) is conjugate base of eurysterol B sulfonic acid (CHEBI:68594)
Incoming Relation(s)
eurysterol B (CHEBI:65889) has part eurysterol B(1−) (CHEBI:68593)
eurysterol B sulfonic acid (CHEBI:68594) is conjugate acid of eurysterol B(1−) (CHEBI:68593)
IUPAC Name 
(3β,5α,6β,22E)-5,6-dihydroxy-8,19-epoxycholest-22-en-3-yl sulfate
Synonym  Source
eurysterol B anionChEBI