CHEBI:93882 - 4-[methyl-(phenylmethyl)amino]-1-phenylbutane-1,3-diol

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ChEBI Name 4-[methyl-(phenylmethyl)amino]-1-phenylbutane-1,3-diol
ChEBI ID CHEBI:93882
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C18H23NO2
Net Charge 0
Average Mass 285.381
Monoisotopic Mass 285.17288
InChI InChI=1S/C18H23NO2/c1-19(13-15-8-4-2-5-9-15)14-17(20)12-18(21)16-10-6-3-7-11-16/h2-11,17-18,20-21H,12-14H2,1H3
InChIKey VBJQDHGYODLBBC-UHFFFAOYSA-N
SMILES CN(CC1=CC=CC=C1)CC(CC(C2=CC=CC=C2)O)O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing 4-[methyl-(phenylmethyl)amino]-1-phenylbutane-1,3-diol (CHEBI:93882) is a benzenes (CHEBI:22712)
4-[methyl-(phenylmethyl)amino]-1-phenylbutane-1,3-diol (CHEBI:93882) is a organic amino compound (CHEBI:50047)
Manual Xref Database
LSM-4456 LINCS
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