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CHEBI:757897 - mgs-0210

Default Structure
ChEBI IDCHEBI:757897
ChEBI Namemgs-0210
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC22H28Cl2FNO5
Net Charge0
Average Mass476.372
Monoisotopic Mass475.13286
SMILES[H][C@@]12C[C@@H](OCc3ccc(Cl)c(Cl)c3)[C@@](N)(C(=O)O)[C@]1([H])[C@@]2(F)C(=O)OCCCCCCC
InChIInChI=1S/C22H28Cl2FNO5/c1-2-3-4-5-6-9-30-20(29)21(25)14-11-17(22(26,18(14)21)19(27)28)31-12-13-7-8-15(23)16(24)10-13/h7-8,10,14,17-18H,2-6,9,11-12,26H2,1H3,(H,27,28)/t14-,17-,18+,21-,22+/m1/s1
InChIKeySVZJNGHWEHDHLT-OUSKECTQSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
mgs-0210 (CHEBI:757897) is a α-amino acid (CHEBI:33704)
Synonyms  Source
BCI-838ChEMBL
Mgs-0210ChEMBL