CHEBI:126209 - N-[(2R,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-2-(1-methyl-3-indolyl)acetamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-[(2R,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-2-(1-methyl-3-indolyl)acetamide
ChEBI ID CHEBI:126209
Stars This entity has been manually annotated by a third party.
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Formula C35H48N4O4
Net Charge 0
Average Mass 588.781
Monoisotopic Mass 588.36756
InChI InChI=1S/C35H48N4O4/c1-24-19-39(25(2)23-40)35(42)18-27-16-29(36-34(41)17-28-21-38(4)31-13-9-8-12-30(28)31)14-15-32(27)43-33(24)22-37(3)20-26-10-6-5-7-11-26/h8-9,12-16,21,24-26,33,40H,5-7,10-11,17-20,22-23H2,1-4H3,(H,36,41)/t24-,25+,33+/m1/s1
InChIKey FGYBIZORLGBRKO-SQJKUQPUSA-N
SMILES C[C@@H]1CN(C(=O)CC2=C(C=CC(=C2)NC(=O)CC3=CN(C4=CC=CC=C43)C)O[C@H]1CN(C)CC5CCCCC5)[C@@H](C)CO
ChEBI Ontology
Outgoing N-[(2R,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-2-(1-methyl-3-indolyl)acetamide (CHEBI:126209) is a indoles (CHEBI:24828)
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