CHEBI:110044 - N-[[(2S,3R)-8-(3-cyclopentylprop-1-ynyl)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methyl-2-thiophenesulfonamide

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ChEBI Name N-[[(2S,3R)-8-(3-cyclopentylprop-1-ynyl)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methyl-2-thiophenesulfonamide ChEBI ID CHEBI:110044 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C27H35N3O5S2 Net Charge 0 Average Mass 545.717 Monoisotopic Mass 545.20181 InChI InChI=1S/C27H35N3O5S2/c1-19-16-30(20(2)18-31)27(32)23-14-22(11-6-10-21-8-4-5-9-21)15-28-26(23)35-24(19)17-29(3)37(33,34)25-12-7-13-36-25/h7,12-15,19-21,24,31H,4-5,8-10,16-18H2,1-3H3/t19-,20+,24-/m1/s1 InChIKey VAEQCBKICRQYMW-JXALWOEJSA-N SMILES C[C@@H]1CN(C(=O)C2=C(N=CC(=C2)C#CCC3CCCC3)O[C@@H]1CN(C)S(=O)(=O)C4=CC=CS4)[C@@H](C)CO ChEBI Ontology Outgoing N-[[(2S,3R)-8-(3-cyclopentylprop-1-ynyl)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methyl-2-thiophenesulfonamide (CHEBI:110044) is a aromatic ether (CHEBI:35618) Manual Xref Database LSM-21471 LINCS View more database links