EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:71326 - callysponginol sulfate A(1−)

ChEBI IDCHEBI:71326
ChEBI Namecallysponginol sulfate A(1−)
Stars
ASCII Namecallysponginol sulfate A(1-)
DefinitionA organosulfate oxoanion that is the monoanion obtained by the deprotonation of the sulfate function of callysponginol sulfonic acid A.
Last Modified3 December 2012
Submitternamrata
DownloadsMolfile
FormulaC24H41O6S
Net Charge-1
Average Mass457.653
Monoisotopic Mass457.26293
SMILESCCCCCC/C=C\CCCCCCCCCCCCC#C[C@@H](OS(=O)(=O)[O-])C(=O)O
InChIInChI=1S/C24H42O6S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24(25)26)30-31(27,28)29/h7-8,23H,2-6,9-20H2,1H3,(H,25,26)(H,27,28,29)/p-1/b8-7-/t23-/m1/s1
InChIKeyYDLFOQAKBQDMDP-XBKFQHLESA-M
ChEBI Ontology
Outgoing Relation(s)
callysponginol sulfate A(1−) (CHEBI:71326) is a organosulfate oxoanion (CHEBI:58958)
callysponginol sulfate A(1−) (CHEBI:71326) is conjugate base of callysponginol sulfonic acid A (CHEBI:71328)
Incoming Relation(s)
callysponginol sulfate A (CHEBI:65567) has part callysponginol sulfate A(1−) (CHEBI:71326)
callysponginol sulfonic acid A (CHEBI:71328) is conjugate acid of callysponginol sulfate A(1−) (CHEBI:71326)
IUPAC Name 
(1R,16Z)-1-carboxytricos-16-en-2-yn-1-yl sulfate