CHEBI:139833 - bkas#12

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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 bkas#12
ChEBI ID CHEBI:139833
Stars This entity has been manually annotated by a third party.
Submitter Michael Witting
Supplier Information
Download Molfile XML SDF
Formula C12H20O7
Net Charge 0
Average Mass 276.283
Monoisotopic Mass 276.12090
InChI InChI=1S/C12H20O7/c1-6(3-8(13)4-11(16)17)18-12-10(15)5-9(14)7(2)19-12/h6-7,9-10,12,14-15H,3-5H2,1-2H3,(H,16,17)/t6-,7+,9-,10-,12-/m1/s1
InChIKey WOLLVTGRGSGBEL-WBAPNQQASA-N
SMILES C[C@H](CC(=O)CC(O)=O)O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O
ChEBI Ontology
Outgoing bkas#12 (CHEBI:139833) is a organic molecular entity (CHEBI:50860)