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CHEBI:139668 - ascr#27(1-)

ChEBI IDCHEBI:139668
ChEBI Nameascr#27(1-)
Stars
DefinitionConjugate base of ascr#27
SubmitterMichael Witting
DownloadsMolfile
FormulaC22H39O6
Net Charge-1
Average Mass399.548
Monoisotopic Mass399.27521
SMILESC[C@H](CCCCCCCCCCC/C=C/C(=O)[O-])O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O
InChIInChI=1S/C22H40O6/c1-17(27-22-20(24)16-19(23)18(2)28-22)14-12-10-8-6-4-3-5-7-9-11-13-15-21(25)26/h13,15,17-20,22-24H,3-12,14,16H2,1-2H3,(H,25,26)/p-1/b15-13+/t17-,18+,19-,20-,22-/m1/s1
InChIKeyPHSQDXKUQRUWOG-PXMSNCRXSA-M
ChEBI Ontology
Outgoing Relation(s)
ascr#27(1-) (CHEBI:139668) is a organic molecular entity (CHEBI:50860)
ascr#27(1-) (CHEBI:139668) is conjugate base of ascr#27 (CHEBI:78965)
Incoming Relation(s)
ascr#27 (CHEBI:78965) is conjugate acid of ascr#27(1-) (CHEBI:139668)