CHEBI:125276 - (4S,5S)-5-[2-(azidomethyl)phenyl]-4-[[2-(azidomethyl)phenyl]methyl]-2-[4-(3-hydroxypropoxy)phenyl]-5H-oxazole-4-carboxamide

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ChEBI Name (4S,5S)-5-[2-(azidomethyl)phenyl]-4-[[2-(azidomethyl)phenyl]methyl]-2-[4-(3-hydroxypropoxy)phenyl]-5H-oxazole-4-carboxamide
ChEBI ID CHEBI:125276
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C28H28N8O4
Net Charge 0
Average Mass 540.574
Monoisotopic Mass 540.22335
InChI InChI=1S/C28H28N8O4/c29-27(38)28(16-20-6-1-2-7-21(20)17-32-35-30)25(24-9-4-3-8-22(24)18-33-36-31)40-26(34-28)19-10-12-23(13-11-19)39-15-5-14-37/h1-4,6-13,25,37H,5,14-18H2,(H2,29,38)/t25-,28-/m0/s1
InChIKey MULJWNBROAHQED-LSYYVWMOSA-N
SMILES C1=CC=C(C(=C1)C[C@]2([C@@H](OC(=N2)C3=CC=C(C=C3)OCCCO)C4=CC=CC=C4CN=[N+]=[N-])C(=O)N)CN=[N+]=[N-]
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Application(s): central nervous system stimulant
Any drug that enhances the activity of the central nervous system.
(via amphetamines )
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ChEBI Ontology
Outgoing (4S,5S)-5-[2-(azidomethyl)phenyl]-4-[[2-(azidomethyl)phenyl]methyl]-2-[4-(3-hydroxypropoxy)phenyl]-5H-oxazole-4-carboxamide (CHEBI:125276) is a amphetamines (CHEBI:35338)
Manual Xref Database
LSM-36746 LINCS
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