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CHEBI:113474 - (8R,9S)-9-[[cyclopentylmethyl(methyl)amino]methyl]-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-5-one

ChEBI IDCHEBI:113474
ChEBI Name(8R,9S)-9-[[cyclopentylmethyl(methyl)amino]methyl]-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-5-one
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DownloadsMolfile
FormulaC22H39N5O3
Net Charge0
Average Mass421.586
Monoisotopic Mass421.30529
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)CCCn2cc(nn2)CO[C@@H]1CN(C)CC1CCCC1
InChIInChI=1S/C22H39N5O3/c1-17-11-27(18(2)15-28)22(29)9-6-10-26-13-20(23-24-26)16-30-21(17)14-25(3)12-19-7-4-5-8-19/h13,17-19,21,28H,4-12,14-16H2,1-3H3/t17-,18-,21-/m1/s1
InChIKeyFRGWQMAVHSUOQI-DBXWQHBBSA-N
ChEBI Ontology
Outgoing Relation(s)
(8R,9S)-9-[[cyclopentylmethyl(methyl)amino]methyl]-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-5-one (CHEBI:113474) is a azamacrocycle (CHEBI:52898)
(8R,9S)-9-[[cyclopentylmethyl(methyl)amino]methyl]-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-5-one (CHEBI:113474) is a lactam (CHEBI:24995)
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LSM-24881LINCS