CHEBI:124128 - 4-(dimethylamino)-N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]butanamide

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ChEBI Name 4-(dimethylamino)-N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]butanamide
ChEBI ID CHEBI:124128
Stars This entity has been manually annotated by a third party.
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Formula C28H41N5O4
Net Charge 0
Average Mass 511.657
Monoisotopic Mass 511.31585
InChI InChI=1S/C28H41N5O4/c1-20-16-33(21(2)19-34)28(36)24-15-23(30-27(35)7-6-14-31(3)4)8-9-25(24)37-26(20)18-32(5)17-22-10-12-29-13-11-22/h8-13,15,20-21,26,34H,6-7,14,16-19H2,1-5H3,(H,30,35)/t20-,21-,26+/m0/s1
InChIKey MVSRNOMMKUCTOT-ISJBWFOZSA-N
SMILES C[C@H]1CN(C(=O)C2=C(C=CC(=C2)NC(=O)CCCN(C)C)O[C@@H]1CN(C)CC3=CC=NC=C3)[C@@H](C)CO
ChEBI Ontology
Outgoing 4-(dimethylamino)-N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]butanamide (CHEBI:124128) is a aromatic amide (CHEBI:62733)
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