CHEBI:139730 - bhas#16(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 bhas#16(1-)
ChEBI ID CHEBI:139730
Definition Conjugate base of bhas#16
Stars This entity has been manually annotated by a third party.
Submitter Michael Witting
Supplier Information
Download Molfile XML SDF
Formula C16H29O7
Net Charge -1
Average Mass 333.398
Monoisotopic Mass 333.19188
InChI InChI=1S/C16H30O7/c1-10(6-4-3-5-7-12(17)8-15(20)21)22-16-14(19)9-13(18)11(2)23-16/h10-14,16-19H,3-9H2,1-2H3,(H,20,21)/p-1/t10-,11+,12-,13-,14-,16-/m1/s1
InChIKey XLKCBPRCWUMKHY-NVWMEEMDSA-M
SMILES C[C@H](CCCCC[C@@H](O)CC([O-])=O)O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O
ChEBI Ontology
Outgoing bhas#16(1-) (CHEBI:139730) is a organic molecular entity (CHEBI:50860)
bhas#16(1-) (CHEBI:139730) is conjugate base of bhas#16 (CHEBI:79227)
Incoming bhas#16 (CHEBI:79227) is conjugate acid of bhas#16(1-) (CHEBI:139730)