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5-Methoxyhinokinin

PropertiesImage
MNX_IDMNXM118259 Image of MNXM118259
referencechebi:175897
formulaC21H20O7
global charge0
mol weight384.384
InChIKeyGDOAQHHMFNQXLJ-UHFFFAOYSA-N
InChIInChI=1S/C21H20O7/c1-23-18-7-13(8-19-20(18)28-11-27-19)5-15-14(9-24-21(15)22)4-12-2-3-16-17(6-12)26-10-25-16/h2-3,6-8,14-15H,4-5,9-11H2,1H3
SMILESCOC1=C2OCOC2=CC(CC2C(=O)OCC2CC2=CC=C3OCOC3=C2)=C1
MNX internals
InChI (mnx)InChI=1/C21H20O7/c1-23-18-7-13(8-19-20(18)28-11-27-19)5-15-14(9-24-21(15)22)4-12-2-3-16-17(6-12)26-10-25-16/h2-3,6-8,14-15H,4-5,9-11H2,1H3/t14?,15? Image of MNXM118259
SMILES (mnx)[CH3:1][O:23][C:18]1=[C:20]2[C:19](=[CH:8][C:13]([CH2:5][CH:15]3[CH:14]([CH2:4][C:12]4=[CH:6][C:17]5=[C:16]([CH:3]=[CH:2]4)[O:25][CH2:10][O:26]5)[CH2:9][O:24][C:21]3=[O:22])=[CH:7]1)[O:27][CH2:11][O:28]2
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:175897
chebi:175897
GDOAQHHMFNQXLJ-UHFFFAOYSA-N
5-Methoxyhinokinin
4-(1,3-benzodioxol-5-ylmethyl)-3-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]oxolan-2-one
hmdb:HMDB0038950
GDOAQHHMFNQXLJ-UHFFFAOYSA-N
5-Methoxyhinokinin
4-(2H-1,3-benzodioxol-5-ylmethyl)-3-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]oxolan-2-one
5-Methoxy-3,4:3',4'-bis(methylenedioxy)lignan-9,9'-olide

hmdb:HMDB38950
secondary/obsolete/fantasy identifier