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3,7-Dihydroxy-2-[4-hydroxy-3-(4-hydroxy-3-methylbutyl)phenyl]-5,6-dimethoxy-4H-1-benzopyran-4-one

PropertiesImage
MNX_IDMNXM23192 Image of MNXM23192
referencelipidmapsM:LMPK12112857
formulaC22H24O8
global charge0
mol weight416.426
InChIKeyQKQBCMSTNUQLPW-UHFFFAOYSA-N
InChIInChI=1S/C22H24O8/c1-11(10-23)4-5-12-8-13(6-7-14(12)24)20-19(27)18(26)17-16(30-20)9-15(25)21(28-2)22(17)29-3/h6-9,11,23-25,27H,4-5,10H2,1-3H3
SMILESCOC1=C(O)C=C2OC(C3=CC(CCC(C)CO)=C(O)C=C3)=C(O)C(=O)C2=C1OC
MNX internals
InChI (mnx)InChI=1/C22H24O8/c1-11(10-23)4-5-12-8-13(6-7-14(12)24)20-19(27)18(26)17-16(30-20)9-15(25)21(28-2)22(17)29-3/h6-9,11,23-25,27H,4-5,10H2,1-3H3/t11? Image of MNXM23192
SMILES (mnx)[CH3:1][CH:11]([CH2:4][CH2:5][C:12]1=[C:14]([OH:24])[CH:7]=[CH:6][C:13]([C:20]2=[C:19]([OH:27])[C:18](=[O:26])[C:17]3=[C:16]([CH:9]=[C:15]([OH:25])[C:21]([O:28][CH3:2])=[C:22]3[O:29][CH3:3])[O:30]2)=[CH:8]1)[CH2:10][OH: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

lipidmaps:LMPK12112857
lipidmapsM:LMPK12112857
QKQBCMSTNUQLPW-UHFFFAOYSA-N
3,7-Dihydroxy-2-[4-hydroxy-3-(4-hydroxy-3-methylbutyl)phenyl]-5,6-dimethoxy-4H-1-benzopyran-4-one