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CHEBI:91789 - LSM-1684

ChEBI IDCHEBI:91789
ChEBI NameLSM-1684
Stars
DownloadsMolfile
FormulaC17H21NO4
Net Charge0
Average Mass303.358
Monoisotopic Mass303.14706
SMILESCN1C2CC(OC(=O)[C@H](CO)c3ccccc3)C[C@H]1[C@H]1OC21
InChIInChI=1S/C17H21NO4/c1-18-13-7-11(8-14(18)16-15(13)22-16)21-17(20)12(9-19)10-5-3-2-4-6-10/h2-6,11-16,19H,7-9H2,1H3/t11?,12-,13+,14?,15-,16?/m1/s1
InChIKeySTECJAGHUSJQJN-OGWGVHNISA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
LSM-1684 (CHEBI:91789) is a 3-hydroxy carboxylic acid (CHEBI:61355)
Manual XrefsDatabases
LSM-1684LINCS