CHEBI:129375 - N-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-(1-tetrazolyl)acetamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-(1-tetrazolyl)acetamide
ChEBI ID CHEBI:129375
Stars This entity has been manually annotated by a third party.
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Download Molfile XML SDF
Formula C27H32F3N7O4
Net Charge 0
Average Mass 575.584
Monoisotopic Mass 575.24679
InChI InChI=1S/C27H32F3N7O4/c1-17-11-37(18(2)15-38)26(40)22-10-21(32-25(39)14-36-16-31-33-34-36)8-9-23(22)41-24(17)13-35(3)12-19-4-6-20(7-5-19)27(28,29)30/h4-10,16-18,24,38H,11-15H2,1-3H3,(H,32,39)/t17-,18-,24+/m1/s1
InChIKey COIGCJCCSTWSLX-GGUMNFRJSA-N
SMILES C[C@@H]1CN(C(=O)C2=C(C=CC(=C2)NC(=O)CN3C=NN=N3)O[C@H]1CN(C)CC4=CC=C(C=C4)C(F)(F)F)[C@H](C)CO
ChEBI Ontology
Outgoing N-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-(1-tetrazolyl)acetamide (CHEBI:129375) is a (trifluoromethyl)benzenes (CHEBI:83565)
Manual Xref Database
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