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CHEBI:128766 - 1-cyclohexyl-3-[(3R,9S,10R)-9-[[cyclohexylmethyl(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]urea

ChEBI IDCHEBI:128766
ChEBI Name1-cyclohexyl-3-[(3R,9S,10R)-9-[[cyclohexylmethyl(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]urea
Stars
DownloadsMolfile
FormulaC36H60N4O5
Net Charge0
Average Mass628.899
Monoisotopic Mass628.45637
SMILESC[C@@H]1CCCCO[C@H](CN(C)CC2CCCCC2)[C@H](C)CN([C@@H](C)CO)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2O1
InChIInChI=1S/C36H60N4O5/c1-26-22-40(27(2)25-41)35(42)32-21-31(38-36(43)37-30-16-9-6-10-17-30)18-19-33(32)45-28(3)13-11-12-20-44-34(26)24-39(4)23-29-14-7-5-8-15-29/h18-19,21,26-30,34,41H,5-17,20,22-25H2,1-4H3,(H2,37,38,43)/t26-,27+,28-,34-/m1/s1
InChIKeyHWJRKQFKDZCYLU-VTRVSUCGSA-N
ChEBI Ontology
Outgoing Relation(s)
1-cyclohexyl-3-[(3R,9S,10R)-9-[[cyclohexylmethyl(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]urea (CHEBI:128766) is a azamacrocycle (CHEBI:52898)
1-cyclohexyl-3-[(3R,9S,10R)-9-[[cyclohexylmethyl(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]urea (CHEBI:128766) is a lactam (CHEBI:24995)
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