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CHEBI:139841 - bkas#16

Default Structure
ChEBI IDCHEBI:139841
ChEBI Namebkas#16
Stars
SubmitterMichael Witting
DownloadsMolfile
FormulaC16H28O7
Net Charge0
Average Mass332.393
Monoisotopic Mass332.18350
SMILESC[C@H](CCCCCC(=O)CC(=O)O)O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O
InChIInChI=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
InChIKeyKLCHBSZWWKJIFZ-DVAKLYJDSA-N
ChEBI Ontology
Outgoing Relation(s)
bkas#16 (CHEBI:139841) is a organic molecular entity (CHEBI:50860)