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Diarylheptanoids

Organic compounds that consist of two aromatic rings joined by a seven-carbon chain that includes other functional groups; also known as diphenylheptanoids.

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1

(E,E)-Bisdemethoxycurcumin, TRC

CAS: 33171-05-0 Molecular Formula: C19 H16 O4 Molecular Weight (g/mol): 308.33 Synonym: 1,6-Heptadiene-3,5-dione, 1,7-bis(4-hydroxyphenyl)-, (1E,6E)-,1,6-Heptadiene-3,5-dione, 1,7-bis(p-hydroxyphenyl)-, (E,E)- (8CI),(1E,6E)-1,7-Bis(4-hydroxyphenyl)-1,6-heptadiene-3,5-dione,Bisdemethoxycurcumin,Bisdesmethoxycurcumin,Curcumin III,Didemethoxycurcumin IUPAC Name: (1E,6E)-1,7-bis(4-hydroxyphenyl)hepta-1,6-diene-3,5-dione SMILES: Oc1ccc(\C=C\C(=O)CC(=O)\C=C\c2ccc(O)cc2)cc1

CAS 33171-05-0
Molecular Weight (g/mol) 308.33
SMILES Oc1ccc(\C=C\C(=O)CC(=O)\C=C\c2ccc(O)cc2)cc1
Synonym 1,6-Heptadiene-3,5-dione, 1,7-bis(4-hydroxyphenyl)-, (1E,6E)-,1,6-Heptadiene-3,5-dione, 1,7-bis(p-hydroxyphenyl)-, (E,E)- (8CI),(1E,6E)-1,7-Bis(4-hydroxyphenyl)-1,6-heptadiene-3,5-dione,Bisdemethoxycurcumin,Bisdesmethoxycurcumin,Curcumin III,Didemethoxycurcumin
IUPAC Name (1E,6E)-1,7-bis(4-hydroxyphenyl)hepta-1,6-diene-3,5-dione
Molecular Formula C19 H16 O4
2

Curcumin, TRC

CAS: 458-37-7 Molecular Formula: C21 H20 O6 Molecular Weight (g/mol): 368.38 Synonym: 1,6-Heptadiene-3,5-dione, 1,7-bis(4-hydroxy-3-methoxyphenyl)-, (E,E)- (8CI),Curcumin (6CI),(1E,6E)-1,7-Bis(4-hydroxy-3-methoxyphenyl)-1,6-heptadiene-3,5-dione,(E)-1,7-Bis(4-hydroxy-3-methoxyphenyl)-1,6-heptadiene-3,5-dione,(E,E)-1,7-Bis(4-hydroxy-3-methoxyphenyl)-1,6-heptadiene-3,5-dione,BR 213,Biocurcumax,C Yellow 15,C.I. 75300,C.I. Natural Yellow 3,Colorant E 100,Curcuma,Curcumax,Curcumin I,Curcumin W,Curcumine,Cureit,Diferuloylmethane,E 100,E 100 (dye),Haidr,Halad,Haldar,Halud,INS 100i,Indian Saffron,Jianghuangsu,Kacha Haldi,Kiriyasu Oil Yellow U,Lipocurc,Longvida,Merita Earth,NSC 32982,NanoCurc,Natural Yellow 3,Natxtra,San-Ei Curcumine AL,San-Ei Gen Curcumine AL,Souchet,Terra Merita,Theracurmin,Theracurmin CR 011L,Turmeric,Turmeric (dye),Turmeric yellow,Ukon,Ukon (dye),Vacurin,Yellow Ginger,Yellow Root,Yo-Kin,trans,trans-Curcumin IUPAC Name: (1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione SMILES: COc1cc(\C=C\C(=O)CC(=O)\C=C\c2ccc(O)c(OC)c2)ccc1O

CAS 458-37-7
Molecular Weight (g/mol) 368.38
SMILES COc1cc(\C=C\C(=O)CC(=O)\C=C\c2ccc(O)c(OC)c2)ccc1O
Synonym 1,6-Heptadiene-3,5-dione, 1,7-bis(4-hydroxy-3-methoxyphenyl)-, (E,E)- (8CI),Curcumin (6CI),(1E,6E)-1,7-Bis(4-hydroxy-3-methoxyphenyl)-1,6-heptadiene-3,5-dione,(E)-1,7-Bis(4-hydroxy-3-methoxyphenyl)-1,6-heptadiene-3,5-dione,(E,E)-1,7-Bis(4-hydroxy-3-methoxyphenyl)-1,6-heptadiene-3,5-dione,BR 213,Biocurcumax,C Yellow 15,C.I. 75300,C.I. Natural Yellow 3,Colorant E 100,Curcuma,Curcumax,Curcumin I,Curcumin W,Curcumine,Cureit,Diferuloylmethane,E 100,E 100 (dye),Haidr,Halad,Haldar,Halud,INS 100i,Indian Saffron,Jianghuangsu,Kacha Haldi,Kiriyasu Oil Yellow U,Lipocurc,Longvida,Merita Earth,NSC 32982,NanoCurc,Natural Yellow 3,Natxtra,San-Ei Curcumine AL,San-Ei Gen Curcumine AL,Souchet,Terra Merita,Theracurmin,Theracurmin CR 011L,Turmeric,Turmeric (dye),Turmeric yellow,Ukon,Ukon (dye),Vacurin,Yellow Ginger,Yellow Root,Yo-Kin,trans,trans-Curcumin
IUPAC Name (1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione
Molecular Formula C21 H20 O6
3

(2E)-Demethoxy Curcumin, TRC

CAS: 22608-11-3 Molecular Formula: C20 H18 O5 Molecular Weight (g/mol): 338.35 Synonym: Demethoxycurcumin,E,E-Desmethoxycurcumin,1,6-Heptadiene-3,5-dione, 1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)-, (1E,6E)-,1,6-Heptadiene-3,5-dione, 1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)-, (E,E)-,1,6-Heptadiene-3,5-dione, 1-(4-hydroxy-3-methoxyphenyl)-7-(p-hydroxyphenyl)- (8CI),(1E,6E)-1-(4-Hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)-1,6-heptadiene-3,5-dione,(1E,6E)-1-(4-Hydroxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)-1,6-heptadiene-3,5-dione,Curcumin II,Demethoxycurcumin,Desmethoxycurcumin,Monodemethoxycurcumin,1,6-Heptadiene-3,5-dione, 1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)-, (1E,6E)-,1,6-Heptadiene-3,5-dione, 1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)-, (E,E)-,1,6-Heptadiene-3,5-dione, 1-(4-hydroxy-3-methoxyphenyl)-7-(p-hydroxyphenyl)- (8CI),(1E,6E)-1-(4-Hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)-1,6-heptadiene-3,5-dione,(1E,6E)-1-(4-Hydroxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)-1,6-heptadiene-3,5-dione,Curcumin II,Demethoxycurcumin,Desmethoxycurcumin,Monodemethoxycurcumin IUPAC Name: (1E,6E)-1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)hepta-1,6-diene-3,5-dione SMILES: COc1cc(\C=C\C(=O)CC(=O)\C=C\c2ccc(O)cc2)ccc1O

CAS 22608-11-3
Molecular Weight (g/mol) 338.35
SMILES COc1cc(\C=C\C(=O)CC(=O)\C=C\c2ccc(O)cc2)ccc1O
Synonym Demethoxycurcumin,E,E-Desmethoxycurcumin,1,6-Heptadiene-3,5-dione, 1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)-, (1E,6E)-,1,6-Heptadiene-3,5-dione, 1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)-, (E,E)-,1,6-Heptadiene-3,5-dione, 1-(4-hydroxy-3-methoxyphenyl)-7-(p-hydroxyphenyl)- (8CI),(1E,6E)-1-(4-Hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)-1,6-heptadiene-3,5-dione,(1E,6E)-1-(4-Hydroxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)-1,6-heptadiene-3,5-dione,Curcumin II,Demethoxycurcumin,Desmethoxycurcumin,Monodemethoxycurcumin,1,6-Heptadiene-3,5-dione, 1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)-, (1E,6E)-,1,6-Heptadiene-3,5-dione, 1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)-, (E,E)-,1,6-Heptadiene-3,5-dione, 1-(4-hydroxy-3-methoxyphenyl)-7-(p-hydroxyphenyl)- (8CI),(1E,6E)-1-(4-Hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)-1,6-heptadiene-3,5-dione,(1E,6E)-1-(4-Hydroxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)-1,6-heptadiene-3,5-dione,Curcumin II,Demethoxycurcumin,Desmethoxycurcumin,Monodemethoxycurcumin
IUPAC Name (1E,6E)-1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)hepta-1,6-diene-3,5-dione
Molecular Formula C20 H18 O5
4

Gingerenone A, TRC

CAS: 128700-97-0 Molecular Formula: C21H24O5 Molecular Weight (g/mol): 356.41 Synonym: (4E)-1,7-bis(4-Hydroxy-3-methoxyphenyl)-4-hepten-3-one,(E)-1,7-bis(4-Hydroxy-3-methoxyphenyl)-4-hepten-3-one; IUPAC Name: (E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hept-4-en-3-one SMILES: COc1cc(CC\C=C\C(=O)CCc2ccc(O)c(OC)c2)ccc1O

CAS 128700-97-0
Molecular Weight (g/mol) 356.41
SMILES COc1cc(CC\C=C\C(=O)CCc2ccc(O)c(OC)c2)ccc1O
Synonym (4E)-1,7-bis(4-Hydroxy-3-methoxyphenyl)-4-hepten-3-one,(E)-1,7-bis(4-Hydroxy-3-methoxyphenyl)-4-hepten-3-one;
IUPAC Name (E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hept-4-en-3-one
Molecular Formula C21H24O5
5

Rottlerin, TRC

CAS: 82-08-6 Molecular Formula: C30 H28 O8 Molecular Weight (g/mol): 516.54 Synonym: 3'-((8-Cinnamoyl-5,7-dihydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)methyl)-2',4',6'-trihydroxy-5'-methyl-acetophenone,Mallotoxin IUPAC Name: (E)-1-[6-[(3-acetyl-2,4,6-trihydroxy-5-methyl-phenyl)methyl]-5,7-dihydroxy-2,2-dimethyl-chromen-8-yl]-3-phenyl-prop-2-en-1-one SMILES: CC(=O)c1c(O)c(C)c(O)c(Cc2c(O)c3C=CC(C)(C)Oc3c(C(=O)\C=C\c4ccccc4)c2O)c1O

CAS 82-08-6
Molecular Weight (g/mol) 516.54
SMILES CC(=O)c1c(O)c(C)c(O)c(Cc2c(O)c3C=CC(C)(C)Oc3c(C(=O)\C=C\c4ccccc4)c2O)c1O
Synonym 3'-((8-Cinnamoyl-5,7-dihydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)methyl)-2',4',6'-trihydroxy-5'-methyl-acetophenone,Mallotoxin
IUPAC Name (E)-1-[6-[(3-acetyl-2,4,6-trihydroxy-5-methyl-phenyl)methyl]-5,7-dihydroxy-2,2-dimethyl-chromen-8-yl]-3-phenyl-prop-2-en-1-one
Molecular Formula C30 H28 O8