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CHEBI:110869 - (3R,9R,10R)-16-amino-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-13-one

ChEBI IDCHEBI:110869
ChEBI Name(3R,9R,10R)-16-amino-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-13-one
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DownloadsMolfile
FormulaC22H37N3O4
Net Charge0
Average Mass407.555
Monoisotopic Mass407.27841
SMILESCNC[C@@H]1OCCCC[C@@H](C)Oc2ccc(N)cc2C(=O)N([C@@H](C)CO)C[C@H]1C
InChIInChI=1S/C22H37N3O4/c1-15-13-25(16(2)14-26)22(27)19-11-18(23)8-9-20(19)29-17(3)7-5-6-10-28-21(15)12-24-4/h8-9,11,15-17,21,24,26H,5-7,10,12-14,23H2,1-4H3/t15-,16+,17-,21+/m1/s1
InChIKeyXRGBJGDCXQTJDT-WOYCLPQFSA-N
ChEBI Ontology
Outgoing Relation(s)
(3R,9R,10R)-16-amino-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-13-one (CHEBI:110869) is a azamacrocycle (CHEBI:52898)
(3R,9R,10R)-16-amino-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-13-one (CHEBI:110869) is a lactam (CHEBI:24995)
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