Concept information
...
organic heterocyclic compound
organic heteropolycyclic compound
organic heterobicyclic compound
furofuran
...
organic heterocyclic compound
organic heteropolycyclic compound
organic heterobicyclic compound
furofuran
Preferred term
(+)-(7r,7'r,7''r,7'''r,8s,8's,8''s,8'''s)-4'',4'''-dihydroxy-3,3',3'',3''',5,5'-hexamethoxy-7,9':7',9-diepoxy-4,8'':4',8'''-bisoxy-8,8'-dineolignan-7'',7''',9'',9'''-tetraol
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C42H50O16
has_role
inchi
- InChI=1S/C42H50O16/c1-49-29-12-21(10-11-27(29)45)36(47)34(17-43)57-41-30(50-2)13-22(14-31(41)51-3)38-25-19-56-39(26(25)20-55-38)23-15-32(52-4)42(33(16-23)53-5)58-35(18-44)37(48)24-8-7-9-28(46)40(24)54-6/h7-16,25-26,34-39,43-48H,17-20H2,1-6H3/t25-,26-,34+,35+,36-,37-,38+,39+/m1/s1
inchikey
- NQKMDFWGODIBLN-HMGMMLPRSA-N
mass
- 810.83680
monoisotopicmass
- 810.30989
smiles
- COc1cc(ccc1O)[C@@H](O)[C@H](CO)Oc1c(OC)cc(cc1OC)[C@@H]1OC[C@@H]2[C@H]1CO[C@H]2c1cc(OC)c(O[C@@H](CO)[C@H](O)c2cccc(O)c2OC)c(OC)c1
subset
- 3_STAR
synonym EXACT
- (1R,2SS)-2-{4-[(1R,3aS,4R,6aS)-4-(4-{[(1R,2S)-1,3-dihydroxy-1-(3-hydroxy-2-methoxyphenyl)propan-2-yl]oxy}-3,5-dimethoxyphenyl)tetrahydro-1H,3H-furo[3,4-c]furan-1-yl]-2,6-dimethoxyphenoxy}-1-(4-hydroxy-3-methoxyphenyl)propane-1,3-diol
In other languages
-
Persian
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:67637
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