1,1′-[[2,4,6-Trihydroxy-5-(1-oxobutyl)-1,3-phenylene]bis[methylene(2,4-dihydroxy-6-methoxy-5-methyl-3,1-phenylene)]]bis[1-butanone]
CAS Registry Number®
55785-59-6
CAS Name
1,1′-[[2,4,6-Trihydroxy-5-(1-oxobutyl)-1,3-phenylene]bis[methylene(2,4-dihydroxy-6-methoxy-5-methyl-3,1-phenylene)]]bis[1-butanone]Molecular Formula
C36H44O12Molecular Mass
668.73Cite this Page
1,1′-[[2,4,6-Trihydroxy-5-(1-oxobutyl)-1,3-phenylene]bis[methylene(2,4-dihydroxy-6-methoxy-5-methyl-3,1-phenylene)]]bis[1-butanone]. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=55785-59-6 (retrieved ) (CAS RN: 55785-59-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C36H44O12/c1-8-11-22(37)25-31(43)20(14-18-28(40)16(4)35(47-6)26(33(18)45)23(38)12-9-2)30(42)21(32(25)44)15-19-29(41)17(5)36(48-7)27(34(19)46)24(39)13-10-3/h40-46H,8-15H2,1-7H3
InChIKey
InChIKey=PFWJPXGNICZIQB-UHFFFAOYSA-N
SMILES
C(C1=C(O)C(CC2=C(O)C(C(CCC)=O)=C(OC)C(C)=C2O)=C(O)C(C(CCC)=O)=C1O)C3=C(O)C(C(CCC)=O)=C(OC)C(C)=C3O
Canonical SMILES
O=C(C=1C(O)=C(C(O)=C(C1O)CC2=C(O)C(C(=O)CCC)=C(OC)C(=C2O)C)CC3=C(O)C(C(=O)CCC)=C(OC)C(=C3O)C)CCC
Other Names for this Substance
- 1-Butanone, 1,1′-[[2,4,6-trihydroxy-5-(1-oxobutyl)-1,3-phenylene]bis[methylene(2,4-dihydroxy-6-methoxy-5-methyl-3,1-phenylene)]]bis-
- 1,1′-[[2,4,6-Trihydroxy-5-(1-oxobutyl)-1,3-phenylene]bis[methylene(2,4-dihydroxy-6-methoxy-5-methyl-3,1-phenylene)]]bis[1-butanone]
- Agrimol C
- 1-[3,5-Bis[(3-butanoyl-2,6-dihydroxy-4-methoxy-5-methylphenyl)methyl]-2,4,6-trihydroxyphenyl]butan-1-one
Deleted or Replaced CAS Registry Numbers
2226721-68-0