CHEBI:125224 - 3-[(4R,5R)-4-carbamoyl-2-[4-(3-hydroxypropoxy)phenyl]-5-phenyl-5H-oxazol-4-yl]propanoic acid tert-butyl ester

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ChEBI Name 3-[(4R,5R)-4-carbamoyl-2-[4-(3-hydroxypropoxy)phenyl]-5-phenyl-5H-oxazol-4-yl]propanoic acid tert-butyl ester
ChEBI ID CHEBI:125224
Stars This entity has been manually annotated by a third party.
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Formula C26H32N2O6
Net Charge 0
Average Mass 468.543
Monoisotopic Mass 468.22604
InChI InChI=1S/C26H32N2O6/c1-25(2,3)34-21(30)14-15-26(24(27)31)22(18-8-5-4-6-9-18)33-23(28-26)19-10-12-20(13-11-19)32-17-7-16-29/h4-6,8-13,22,29H,7,14-17H2,1-3H3,(H2,27,31)/t22-,26-/m1/s1
InChIKey PIXILRNRMRRSLQ-ATIYNZHBSA-N
SMILES CC(C)(C)OC(=O)CC[C@@]1([C@H](OC(=N1)C2=CC=C(C=C2)OCCCO)C3=CC=CC=C3)C(=O)N
ChEBI Ontology
Outgoing 3-[(4R,5R)-4-carbamoyl-2-[4-(3-hydroxypropoxy)phenyl]-5-phenyl-5H-oxazol-4-yl]propanoic acid tert-butyl ester (CHEBI:125224) has functional parent α-amino acid (CHEBI:33704)
3-[(4R,5R)-4-carbamoyl-2-[4-(3-hydroxypropoxy)phenyl]-5-phenyl-5H-oxazol-4-yl]propanoic acid tert-butyl ester (CHEBI:125224) is a tert-butyl ester (CHEBI:140402)
3-[(4R,5R)-4-carbamoyl-2-[4-(3-hydroxypropoxy)phenyl]-5-phenyl-5H-oxazol-4-yl]propanoic acid tert-butyl ester (CHEBI:125224) is a organonitrogen compound (CHEBI:35352)
3-[(4R,5R)-4-carbamoyl-2-[4-(3-hydroxypropoxy)phenyl]-5-phenyl-5H-oxazol-4-yl]propanoic acid tert-butyl ester (CHEBI:125224) is a organooxygen compound (CHEBI:36963)
Manual Xref Database
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Last Modified
09 March 2018