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1-[4-(3-hydroxy-2-methoxyphenyl)-4-(3-hydroxy-4-methoxyphenyl)-1-piperidinyl]ethanone

PropertiesImage
MNX_IDMNXM341011 Image of MNXM341011
referencechebi:93000
formulaC21H25NO5
global charge0
mol weight371.433
InChIKeyOUIJROJMBAIVSY-UHFFFAOYSA-N
InChIInChI=1S/C21H25NO5/c1-14(23)22-11-9-21(10-12-22,15-7-8-19(26-2)18(25)13-15)16-5-4-6-17(24)20(16)27-3/h4-8,13,24-25H,9-12H2,1-3H3
SMILESCOC1=C(O)C=C(C2(C3=C(OC)C(O)=CC=C3)CCN(C(C)=O)CC2)C=C1
MNX internals
InChI (mnx)InChI=1/C21H25NO5/c1-14(23)22-11-9-21(10-12-22,15-7-8-19(26-2)18(25)13-15)16-5-4-6-17(24)20(16)27-3/h4-8,13,24-25H,9-12H2,1-3H3 Image of MNXM341011
SMILES (mnx)[CH3:1][C:14]([N:22]1[CH2:11][CH2:9][C:21]([C:15]2=[CH:13][C:18]([OH:25])=[C:19]([O:26][CH3:2])[CH:8]=[CH:7]2)([C:16]2=[C:20]([O:27][CH3:3])[C:17]([OH:24])=[CH:6][CH:4]=[CH:5]2)[CH2:10][CH2:12]1)=[O:23]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:93000
chebi:93000
OUIJROJMBAIVSY-UHFFFAOYSA-N
1-[4-(3-hydroxy-2-methoxyphenyl)-4-(3-hydroxy-4-methoxyphenyl)-1-piperidinyl]ethanone