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Bucegin

PropertiesImage
MNX_IDMNXM44870 Image of MNXM44870
referencelipidmapsM:LMPK12111366
formulaC17H14O6
global charge0
mol weight314.293
InChIKeyMRQSJFKGZKPPNM-UHFFFAOYSA-N
InChIInChI=1S/C17H14O6/c1-21-10-5-3-9(4-6-10)14-8-12(19)15-11(18)7-13(20)16(22-2)17(15)23-14/h3-8,18,20H,1-2H3
SMILESCOC1=CC=C(C2=CC(=O)C3=C(O2)C(OC)=C(O)C=C3O)C=C1
MNX internals
InChI (mnx)InChI=1/C17H14O6/c1-21-10-5-3-9(4-6-10)14-8-12(19)15-11(18)7-13(20)16(22-2)17(15)23-14/h3-8,18,20H,1-2H3 Image of MNXM44870
SMILES (mnx)[CH3:1][O:21][C:10]1=[CH:6][CH:4]=[C:9]([C:14]2=[CH:8][C:12](=[O:19])[C:15]3=[C:17]([C:16]([O:22][CH3:2])=[C:13]([OH:20])[CH:7]=[C:11]3[OH:18])[O:23]2)[CH:3]=[CH:5]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

lipidmaps:LMPK12111366
lipidmapsM:LMPK12111366
MRQSJFKGZKPPNM-UHFFFAOYSA-N 		Bucegin
Galangustin