EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:139881 - bkas#34(1-)

Default Structure
ChEBI IDCHEBI:139881
ChEBI Namebkas#34(1-)
Stars
DefinitionConjugate base of bkas#34
SubmitterMichael Witting
DownloadsMolfile
FormulaC25H45O7
Net Charge-1
Average Mass457.628
Monoisotopic Mass457.31708
SMILESC[C@H](CCCCCCCCCCCCCCC(=O)CC(=O)[O-])O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O
InChIInChI=1S/C25H46O7/c1-19(31-25-23(28)18-22(27)20(2)32-25)15-13-11-9-7-5-3-4-6-8-10-12-14-16-21(26)17-24(29)30/h19-20,22-23,25,27-28H,3-18H2,1-2H3,(H,29,30)/p-1/t19-,20+,22-,23-,25-/m1/s1
InChIKeyWUFAAKWTJAFYDQ-ZJSDICRLSA-M
ChEBI Ontology
Outgoing Relation(s)
bkas#34(1-) (CHEBI:139881) is a organic molecular entity (CHEBI:50860)