N-[(3S,9R,10S)-9-[[benzenesulfonyl(methyl)amino]methyl]-12-[(2R)-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]-4-(dimethylamino)butanamide (CHEBI:126158)

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CHEBI:126158 - N-[(3S,9R,10S)-9-[[benzenesulfonyl(methyl)amino]methyl]-12-[(2R)-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]-4-(dimethylamino)butanamide

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ChEBI ID	CHEBI:126158
ChEBI Name	N-[(3S,9R,10S)-9-[[benzenesulfonyl(methyl)amino]methyl]-12-[(2R)-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]-4-(dimethylamino)butanamide
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Downloads	Molfile

Formula	C34H52N4O7S
Net Charge	0
Average Mass	660.878
Monoisotopic Mass	660.35567
SMILES	C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O
InChI	InChI=1S/C34H52N4O7S/c1-25-22-38(26(2)24-39)34(41)30-21-28(35-33(40)16-12-19-36(4)5)17-18-31(30)45-27(3)13-10-11-20-44-32(25)23-37(6)46(42,43)29-14-8-7-9-15-29/h7-9,14-15,17-18,21,25-27,32,39H,10-13,16,19-20,22-24H2,1-6H3,(H,35,40)/t25-,26+,27-,32-/m0/s1
InChIKey	XJDNFUDAKLJUOC-XTQYNZLPSA-N

ChEBI Ontology

Outgoing Relation(s)
	N-[(3S,9R,10S)-9-[[benzenesulfonyl(methyl)amino]methyl]-12-[(2R)-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]-4-(dimethylamino)butanamide (CHEBI:126158) is a azamacrocycle (CHEBI:52898)
	N-[(3S,9R,10S)-9-[[benzenesulfonyl(methyl)amino]methyl]-12-[(2R)-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]-4-(dimethylamino)butanamide (CHEBI:126158) is a lactam (CHEBI:24995)

Manual Xrefs	Databases
LSM-37725	LINCS