CHEBI:130016 - N-[(2R,3R)-2-[[[(4-fluoroanilino)-oxomethyl]-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclopropanecarboxamide

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ChEBI Name N-[(2R,3R)-2-[[[(4-fluoroanilino)-oxomethyl]-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclopropanecarboxamide
ChEBI ID CHEBI:130016
Stars This entity has been manually annotated by a third party.
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Formula C27H33FN4O5
Net Charge 0
Average Mass 512.574
Monoisotopic Mass 512.24350
InChI InChI=1S/C27H33FN4O5/c1-16-13-32(17(2)15-33)26(35)22-12-21(29-25(34)18-4-5-18)10-11-23(22)37-24(16)14-31(3)27(36)30-20-8-6-19(28)7-9-20/h6-12,16-18,24,33H,4-5,13-15H2,1-3H3,(H,29,34)(H,30,36)/t16-,17-,24+/m1/s1
InChIKey OTRZZVMKCVISTM-OJLQRUNKSA-N
SMILES C[C@@H]1CN(C(=O)C2=C(C=CC(=C2)NC(=O)C3CC3)O[C@H]1CN(C)C(=O)NC4=CC=C(C=C4)F)[C@H](C)CO
ChEBI Ontology
Outgoing N-[(2R,3R)-2-[[[(4-fluoroanilino)-oxomethyl]-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclopropanecarboxamide (CHEBI:130016) is a ureas (CHEBI:47857)
Manual Xref Database
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