CHEBI:139841 - bkas#16

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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#16
ChEBI ID CHEBI:139841
Stars This entity has been manually annotated by a third party.
Submitter Michael Witting
Supplier Information
Download Molfile XML SDF
Formula C16H28O7
Net Charge 0
Average Mass 332.390
Monoisotopic Mass 332.18350
InChI InChI=1S/C16H28O7/c1-10(6-4-3-5-7-12(17)8-15(20)21)22-16-14(19)9-13(18)11(2)23-16/h10-11,13-14,16,18-19H,3-9H2,1-2H3,(H,20,21)/t10-,11+,13-,14-,16-/m1/s1
InChIKey KLCHBSZWWKJIFZ-DVAKLYJDSA-N
SMILES C[C@H](CCCCCC(=O)CC(O)=O)O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O
ChEBI Ontology
Outgoing bkas#16 (CHEBI:139841) is a organic molecular entity (CHEBI:50860)