Search MNXref
 Feedback

Anhalonine

PropertiesImage
MNX_IDMNXM10713 Image of MNXM10713
referencechebi:80670
formulaC13H19NO3
global charge0
mol weight237.299
InChIKeyVMFUYWSNWQYUTG-UHFFFAOYSA-N
InChIInChI=1S/C13H19NO3/c1-8-11-9(5-6-14-8)7-10(15-2)12(16-3)13(11)17-4/h7-8,14H,5-6H2,1-4H3
SMILESCOC1=C(OC)C(OC)=C2C(=C1)CCNC2C
MNX internals
InChI (mnx)InChI=1/C13H19NO3/c1-8-11-9(5-6-14-8)7-10(15-2)12(16-3)13(11)17-4/h7-8,14H,5-6H2,1-4H3/t8? Image of MNXM10713
SMILES (mnx)[CH3:1][CH:8]1[C:11]2=[C:13]([O:17][CH3:4])[C:12]([O:16][CH3:3])=[C:10]([O:15][CH3:2])[CH:7]=[C:9]2[CH2:5][CH2:6][NH:14]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

seed.compound:cpd16512
seedM:cpd16512
CHEBI:80670
chebi:80670
kegg.compound:C16705
keggC:C16705
VMFUYWSNWQYUTG-UHFFFAOYSA-N
VMFUYWSNWQYUTG-UHFFFAOYSA-O 		Anhalonine
O-Methylanhalonidine

vmhM:ahnl
vmhmetabolite:ahnl
VMFUYWSNWQYUTG-UHFFFAOYSA-N 		Anhalonine

keggC:M_C16705
seedM:M_cpd16512
vmhM:M_ahnl 		secondary/obsolete/fantasy identifier