CHEBI:139880 - bkas#34

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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#34
ChEBI ID CHEBI:139880
Stars This entity has been manually annotated by a third party.
Submitter Michael Witting
Supplier Information
Download Molfile XML SDF
Formula C25H46O7
Net Charge 0
Average Mass 458.630
Monoisotopic Mass 458.32435
InChI InChI=1S/C25H46O7/c1-19(31-25-23(28)18-22(27)20(2)32-25)15-13-11-9-7-5-3-4-6-8-10-12-14-16-21(26)17-24(29)30/h19-20,22-23,25,27-28H,3-18H2,1-2H3,(H,29,30)/t19-,20+,22-,23-,25-/m1/s1
InChIKey WUFAAKWTJAFYDQ-ZJSDICRLSA-N
SMILES C[C@H](CCCCCCCCCCCCCCC(=O)CC(O)=O)O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O
ChEBI Ontology
Outgoing bkas#34 (CHEBI:139880) is a organic molecular entity (CHEBI:50860)