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4',3''-di-O-methylapocynin-D

PropertiesImage
MNX_IDMNXM101923 Image of MNXM101923
referencechebi:70260
formulaC26H24O10
global charge0
mol weight496.468
InChIKeyHYDZYHSPOSOKQM-ZXWJAXLNSA-N
InChIInChI=1S/C26H24O10/c1-33-21-7-11(3-4-15(21)27)13-9-22(32)36-25-14-8-19(31)24(35-20(14)10-16(28)23(13)25)12-5-17(29)26(34-2)18(30)6-12/h3-7,10,13,19,24,27-31H,8-9H2,1-2H3/t13-,19+,24-/m1/s1
SMILESCOC1=CC([C@H]2CC(=O)OC3=C2C(O)=CC2=C3C[C@H](O)[C@@H](C3=CC(O)=C(OC)C(O)=C3)O2)=CC=C1O
MNX internals
InChI (mnx)InChI=1/C26H24O10/c1-33-21-7-11(3-4-15(21)27)13-9-22(32)36-25-14-8-19(31)24(35-20(14)10-16(28)23(13)25)12-5-17(29)26(34-2)18(30)6-12/h3-7,10,13,19,24,27-31H,8-9H2,1-2H3/t13-,19+,24-/m1/s1 Image of MNXM101923
SMILES (mnx)[CH3:1][O:33][C:21]1=[C:15]([OH:27])[CH:4]=[CH:3][C:11]([C@H:13]2[CH2:9][C:22](=[O:32])[O:36][C:25]3=[C:14]4[CH2:8][C@H:19]([OH:31])[C@@H:24]([C:12]5=[CH:5][C:17]([OH:29])=[C:26]([O:34][CH3:2])[C:18]([OH:30])=[CH:6]5)[O:35][C:20]4=[CH:10][C:16]([OH:28])=[C:23]23)=[CH:7]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:70260
chebi:70260
HYDZYHSPOSOKQM-ZXWJAXLNSA-N
4',3''-di-O-methylapocynin-D