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CHEBI:126394 - N-[(3R,9S,10R)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2S)-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]methanesulfonamide

ChEBI IDCHEBI:126394
ChEBI NameN-[(3R,9S,10R)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2S)-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]methanesulfonamide
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DownloadsMolfile
FormulaC27H45N3O6S
Net Charge0
Average Mass539.739
Monoisotopic Mass539.30291
SMILESC[C@@H]1CCCCO[C@H](CN(C)CC2CC2)[C@H](C)CN([C@@H](C)CO)C(=O)c2cc(NS(C)(=O)=O)ccc2O1
InChIInChI=1S/C27H45N3O6S/c1-19-15-30(20(2)18-31)27(32)24-14-23(28-37(5,33)34)11-12-25(24)36-21(3)8-6-7-13-35-26(19)17-29(4)16-22-9-10-22/h11-12,14,19-22,26,28,31H,6-10,13,15-18H2,1-5H3/t19-,20+,21-,26-/m1/s1
InChIKeyDRBRVKGUSIXHOZ-SBZFUYPRSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(3R,9S,10R)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2S)-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]methanesulfonamide (CHEBI:126394) is a azamacrocycle (CHEBI:52898)
N-[(3R,9S,10R)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2S)-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]methanesulfonamide (CHEBI:126394) is a lactam (CHEBI:24995)
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