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CHEBI:117693 - N-[(3R,9S,10S)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-methylbenzenesulfonamide

ChEBI IDCHEBI:117693
ChEBI NameN-[(3R,9S,10S)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-methylbenzenesulfonamide
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Last Modified3 March 2016
DownloadsMolfile
FormulaC33H49N3O6S
Net Charge0
Average Mass615.837
Monoisotopic Mass615.33421
SMILESCc1ccc(S(=O)(=O)Nc2ccc3c(c2)C(=O)N([C@H](C)CO)C[C@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@@H](C)O3)cc1
InChIInChI=1S/C33H49N3O6S/c1-23-9-14-29(15-10-23)43(39,40)34-28-13-16-31-30(18-28)33(38)36(25(3)22-37)19-24(2)32(21-35(5)20-27-11-12-27)41-17-7-6-8-26(4)42-31/h9-10,13-16,18,24-27,32,34,37H,6-8,11-12,17,19-22H2,1-5H3/t24-,25+,26+,32+/m0/s1
InChIKeyIJPCFLZWEMVLEC-MQBJWECPSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(3R,9S,10S)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-methylbenzenesulfonamide (CHEBI:117693) is a azamacrocycle (CHEBI:52898)
N-[(3R,9S,10S)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-methylbenzenesulfonamide (CHEBI:117693) is a lactam (CHEBI:24995)
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