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CHEBI:93224 - (1S,2S)-2-[(1S)-1-amino-1-carboxy-2-(9H-xanthen-9-yl)ethyl]-1-cyclopropanecarboxylic acid

ChEBI IDCHEBI:93224
ChEBI Name(1S,2S)-2-[(1S)-1-amino-1-carboxy-2-(9H-xanthen-9-yl)ethyl]-1-cyclopropanecarboxylic acid
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FormulaC20H19NO5
Net Charge0
Average Mass353.374
Monoisotopic Mass353.12632
SMILESN[C@](CC1c2ccccc2Oc2ccccc21)(C(=O)O)[C@H]1C[C@@H]1C(=O)O
InChIInChI=1S/C20H19NO5/c21-20(19(24)25,15-9-13(15)18(22)23)10-14-11-5-1-3-7-16(11)26-17-8-4-2-6-12(14)17/h1-8,13-15H,9-10,21H2,(H,22,23)(H,24,25)/t13-,15-,20-/m0/s1
InChIKeyVLZBRVJVCCNPRJ-KPHUOKFYSA-N
ChEBI Ontology
Outgoing Relation(s)
(1S,2S)-2-[(1S)-1-amino-1-carboxy-2-(9H-xanthen-9-yl)ethyl]-1-cyclopropanecarboxylic acid (CHEBI:93224) is a xanthenes (CHEBI:38835)
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LSM-3560LINCS