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(-)-tortuosamine

PropertiesImage
MNX_IDMNXM30367 Image of MNXM30367
referencechebi:31030
formulaC20H26N2O2
global charge0
mol weight326.44
InChIKeyQFRVOGLOHJOHAY-HXUWFJFHSA-N
InChIInChI=1S/C20H26N2O2/c1-21-12-10-20(9-8-17-15(14-20)5-4-11-22-17)16-6-7-18(23-2)19(13-16)24-3/h4-7,11,13,21H,8-10,12,14H2,1-3H3/t20-/m1/s1
SMILESCNCC[C@]1(C2=CC(OC)=C(OC)C=C2)CCC2=C(C=CC=N2)C1
MNX internals
InChI (mnx)InChI=1/C20H26N2O2/c1-21-12-10-20(9-8-17-15(14-20)5-4-11-22-17)16-6-7-18(23-2)19(13-16)24-3/h4-7,11,13,21H,8-10,12,14H2,1-3H3/t20-/m1/s1 Image of MNXM30367
SMILES (mnx)[CH3:1][NH:21][CH2:12][CH2:10][C@:20]1([C:16]2=[CH:13][C:19]([O:24][CH3:3])=[C:18]([O:23][CH3:2])[CH:7]=[CH:6]2)[CH2:9][CH2:8][C:17]2=[C:15]([CH:5]=[CH:4][CH:11]=[N:22]2)[CH2:14]1
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:31030
chebi:31030
QFRVOGLOHJOHAY-HXUWFJFHSA-N 		(-)-tortuosamine
(-)-Tortuosamine
2-[(6S)-6-(3,4-dimethoxyphenyl)-5,6,7,8-tetrahydroquinolin-6-yl]-N-methylethanamine
Tortuosamine

kegg.compound:C12260
keggC:C12260
QFRVOGLOHJOHAY-HXUWFJFHSA-N 		(-)-Tortuosamine
Tortuosamine

seed.compound:cpd09039
seedM:cpd09039
QFRVOGLOHJOHAY-HXUWFJFHSA-O 		Tortuosamine
(-)-Tortuosamine

keggC:M_C12260
seedM:M_cpd09039 		secondary/obsolete/fantasy identifier