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CHEBI:125415 - 7-[(3-chloro-6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepin-11-yl)amino]-N-hydroxyheptanamide

Default Structure
ChEBI IDCHEBI:125415
ChEBI Name7-[(3-chloro-6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepin-11-yl)amino]-N-hydroxyheptanamide
Stars
DownloadsMolfile
FormulaC21H26ClN3O4S
Net Charge0
Average Mass451.976
Monoisotopic Mass451.13325
SMILESCN1c2ccccc2C(NCCCCCCC(=O)NO)c2ccc(Cl)cc2S1(=O)=O
InChIInChI=1S/C21H26ClN3O4S/c1-25-18-9-6-5-8-16(18)21(23-13-7-3-2-4-10-20(26)24-27)17-12-11-15(22)14-19(17)30(25,28)29/h5-6,8-9,11-12,14,21,23,27H,2-4,7,10,13H2,1H3,(H,24,26)
InChIKeyRQXKGXKJNPGJGP-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
7-[(3-chloro-6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepin-11-yl)amino]-N-hydroxyheptanamide (CHEBI:125415) is a aralkylamine (CHEBI:18000)
Manual XrefsDatabases
LSM-36901LINCS