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syringylresinol diacetate

PropertiesImage
MNX_IDMNXM161388 Image of MNXM161388
referencechebi:86951
formulaC26H30O10
global charge0
mol weight502.516
InChIKeyFEDJEJQAGQWOHV-UHFFFAOYSA-N
InChIInChI=1S/C26H30O10/c1-13(27)35-25-19(29-3)7-15(8-20(25)30-4)23-17-11-34-24(18(17)12-33-23)16-9-21(31-5)26(36-14(2)28)22(10-16)32-6/h7-10,17-18,23-24H,11-12H2,1-6H3
SMILESCOC1=CC(C2OCC3C(C4=CC(OC)=C(OC(C)=O)C(OC)=C4)OCC23)=CC(OC)=C1OC(C)=O
MNX internals
InChI (mnx)InChI=1/C26H30O10/c1-13(27)35-25-19(29-3)7-15(8-20(25)30-4)23-17-11-34-24(18(17)12-33-23)16-9-21(31-5)26(36-14(2)28)22(10-16)32-6/h7-10,17-18,23-24H,11-12H2,1-6H3/t17?,18?,23?,24? Image of MNXM161388
SMILES (mnx)[CH3:1][C:13](=[O:27])[O:35][C:25]1=[C:19]([O:29][CH3:3])[CH:7]=[C:15]([CH:23]2[CH:17]3[CH2:11][O:34][CH:24]([C:16]4=[CH:9][C:21]([O:31][CH3:5])=[C:26]([O:36][C:14]([CH3:2])=[O:28])[C:22]([O:32][CH3:6])=[CH:10]4)[CH:18]3[CH2:12][O:33]2)[CH:8]=[C:20]1[O:30][CH3:4]
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:86951
chebi:86951
FEDJEJQAGQWOHV-UHFFFAOYSA-N
syringylresinol diacetate
(tetrahydro-1H,3H-furo[3,4-c]furan-1,4-diyl)bis(2,6-dimethoxy-4,1-phenylene) diacetate