CHEBI:124521 - N-[(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]methanesulfonamide

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ChEBI Name N-[(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]methanesulfonamide
ChEBI ID CHEBI:124521
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C24H39N3O5S
Net Charge 0
Average Mass 481.651
Monoisotopic Mass 481.26104
InChI InChI=1S/C24H39N3O5S/c1-17-13-27(18(2)16-28)24(29)20-11-8-12-21(25-33(4,30)31)23(20)32-22(17)15-26(3)14-19-9-6-5-7-10-19/h8,11-12,17-19,22,25,28H,5-7,9-10,13-16H2,1-4H3/t17-,18+,22-/m1/s1
InChIKey IMAPSPJJRPXTJM-KGVIQGDOSA-N
SMILES C[C@@H]1CN(C(=O)C2=C(C(=CC=C2)NS(=O)(=O)C)O[C@@H]1CN(C)CC3CCCCC3)[C@@H](C)CO
ChEBI Ontology
Outgoing N-[(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]methanesulfonamide (CHEBI:124521) is a sulfonamide (CHEBI:35358)
Manual Xref Database
LSM-35963 LINCS
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