CHEBI:116059 - N-[(5R,6R,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-propyl-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]methanesulfonamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-[(5R,6R,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-propyl-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]methanesulfonamide
ChEBI ID CHEBI:116059
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C21H35N3O5S
Net Charge 0
Average Mass 441.587
Monoisotopic Mass 441.22974
InChI InChI=1S/C21H35N3O5S/c1-7-10-24-12-15(2)20(28-5)13-23(4)21(25)18-9-8-17(22-30(6,26)27)11-19(18)29-14-16(24)3/h8-9,11,15-16,20,22H,7,10,12-14H2,1-6H3/t15-,16+,20+/m1/s1
InChIKey LSBAXAJPBMYKOG-GUXCAODWSA-N
SMILES CCCN1C[C@H]([C@H](CN(C(=O)C2=C(C=C(C=C2)NS(=O)(=O)C)OC[C@@H]1C)C)OC)C
ChEBI Ontology
Outgoing N-[(5R,6R,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-propyl-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]methanesulfonamide (CHEBI:116059) is a azamacrocycle (CHEBI:52898)
N-[(5R,6R,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-propyl-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]methanesulfonamide (CHEBI:116059) is a lactam (CHEBI:24995)
Manual Xref Database
LSM-27515 LINCS
View more database links