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CHEBI:759969 - evategrel

Default Structure
ChEBI IDCHEBI:759969
ChEBI Nameevategrel
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC21H26ClNO7S
Net Charge0
Average Mass471.959
Monoisotopic Mass471.11185
SMILESCOC(=O)[C@H](c1ccccc1Cl)N1CC[C@@H](SCOC(=O)OC(C)C)/C(=C\C(=O)O)C1
InChIInChI=1S/C21H26ClNO7S/c1-13(2)30-21(27)29-12-31-17-8-9-23(11-14(17)10-18(24)25)19(20(26)28-3)15-6-4-5-7-16(15)22/h4-7,10,13,17,19H,8-9,11-12H2,1-3H3,(H,24,25)/b14-10-/t17-,19+/m1/s1
InChIKeyJIHSKBXKKCQDED-DIJKAEOVSA-N
ChEBI Ontology
Outgoing Relation(s)
evategrel (CHEBI:759969) is a α-amino acid ester (CHEBI:46874)
INN  Source
evategrelWHO MedNet