CHEBI:139678 - ascr#30(1-)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name ascr#30(1-)
ChEBI ID CHEBI:139678
Definition Conjugate base of ascr#30
Stars This entity has been manually annotated by a third party.
Submitter Michael Witting
Supplier Information
Download Molfile XML SDF
Formula C23H43O6
Net Charge -1
Average Mass 415.585
Monoisotopic Mass 415.30651
InChI InChI=1S/C23H44O6/c1-18(28-23-21(25)17-20(24)19(2)29-23)15-13-11-9-7-5-3-4-6-8-10-12-14-16-22(26)27/h18-21,23-25H,3-17H2,1-2H3,(H,26,27)/p-1/t18-,19+,20-,21-,23-/m1/s1
InChIKey XIVYAVYHUZLGIV-AIDNLNPPSA-M
SMILES C[C@H](CCCCCCCCCCCCCCC([O-])=O)O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O
ChEBI Ontology
Outgoing ascr#30(1-) (CHEBI:139678) is a organic molecular entity (CHEBI:50860)
ascr#30(1-) (CHEBI:139678) is conjugate base of ascr#30 (CHEBI:78968)
Incoming ascr#30 (CHEBI:78968) is conjugate acid of ascr#30(1-) (CHEBI:139678)