N-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methylcarbamic acid propan-2-yl ester (CHEBI:113313)

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CHEBI:113313 - N-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methylcarbamic acid propan-2-yl ester

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ChEBI ID	CHEBI:113313
ChEBI Name	N-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methylcarbamic acid propan-2-yl ester
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Downloads	Molfile

Formula	C20H35N5O5
Net Charge	0
Average Mass	425.530
Monoisotopic Mass	425.26382
SMILES	CC(C)OC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N([C@@H](C)CO)C[C@@H]1C
InChI	InChI=1S/C20H35N5O5/c1-14(2)30-20(28)23(5)11-18-15(3)10-24(16(4)12-26)19(27)7-6-8-25-17(13-29-18)9-21-22-25/h9,14-16,18,26H,6-8,10-13H2,1-5H3/t15-,16-,18-/m0/s1
InChIKey	IKLKAEKDATVYNM-BQFCYCMXSA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methylcarbamic acid propan-2-yl ester (CHEBI:113313) is a azamacrocycle (CHEBI:52898)
	N-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methylcarbamic acid propan-2-yl ester (CHEBI:113313) is a lactam (CHEBI:24995)

Manual Xrefs	Databases
LSM-24724	LINCS