CHEBI:125168 - (4R,5R)-4-[2-(benzenesulfonyl)ethyl]-N-(2,3-dihydroxypropyl)-2-[4-(3-hydroxypropoxy)phenyl]-5-phenyl-5H-oxazole-4-carboxamide

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ChEBI Name (4R,5R)-4-[2-(benzenesulfonyl)ethyl]-N-(2,3-dihydroxypropyl)-2-[4-(3-hydroxypropoxy)phenyl]-5-phenyl-5H-oxazole-4-carboxamide
ChEBI ID CHEBI:125168
Stars This entity has been manually annotated by a third party.
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Formula C30H34N2O8S
Net Charge 0
Average Mass 582.667
Monoisotopic Mass 582.20359
InChI InChI=1S/C30H34N2O8S/c33-17-7-18-39-25-14-12-23(13-15-25)28-32-30(29(36)31-20-24(35)21-34,27(40-28)22-8-3-1-4-9-22)16-19-41(37,38)26-10-5-2-6-11-26/h1-6,8-15,24,27,33-35H,7,16-21H2,(H,31,36)/t24?,27-,30-/m1/s1
InChIKey XFVMNKBBHXQPDR-HLJLCESISA-N
SMILES C1=CC=C(C=C1)[C@@H]2[C@](N=C(O2)C3=CC=C(C=C3)OCCCO)(CCS(=O)(=O)C4=CC=CC=C4)C(=O)NCC(CO)O
ChEBI Ontology
Outgoing (4R,5R)-4-[2-(benzenesulfonyl)ethyl]-N-(2,3-dihydroxypropyl)-2-[4-(3-hydroxypropoxy)phenyl]-5-phenyl-5H-oxazole-4-carboxamide (CHEBI:125168) has functional parent α-amino acid (CHEBI:33704)
(4R,5R)-4-[2-(benzenesulfonyl)ethyl]-N-(2,3-dihydroxypropyl)-2-[4-(3-hydroxypropoxy)phenyl]-5-phenyl-5H-oxazole-4-carboxamide (CHEBI:125168) is a organonitrogen compound (CHEBI:35352)
(4R,5R)-4-[2-(benzenesulfonyl)ethyl]-N-(2,3-dihydroxypropyl)-2-[4-(3-hydroxypropoxy)phenyl]-5-phenyl-5H-oxazole-4-carboxamide (CHEBI:125168) is a organooxygen compound (CHEBI:36963)
Manual Xref Database
LSM-36634 LINCS
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