Flavonoids
Quercetin, TRC
CAS: 117-39-5 Molecular Formula: C15 H10 O7 Molecular Weight (g/mol): 302.24 Synonym: 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-,Flavone, 3,3',4',5,7-pentahydroxy- (7CI,8CI),Flavone, 3,4',5,5',7-pentahydroxy- (6CI),2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-4H-1-benzopyran-4-one,2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-4H-benzopyran-4-one,3,3',4',5,7-Pentahydroxyflavone,3,5,7,3',4'-Pentahydroxyflavone,3,5,7-Trihydroxy-2-(3,4-dihydroxyphenyl)-4H-chromen-4-one,3'-Hydroxykaempferol,C.I. 75670,Corvitin,Cyanidelonon 1522,Korvitin,LDN 0052529,Lipoflavon,Meletin,NSC 57655,NSC 9219,Quercetin,Quercetine,Quercetol,Quertin,Quertine,Sophoretin,Xanthaurine IUPAC Name: 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromen-4-one SMILES: OC1=C(Oc2cc(O)cc(O)c2C1=O)c3ccc(O)c(O)c3
Orientin, TRC
CAS: 28608-75-5 Molecular Formula: C21 H20 O11 Molecular Weight (g/mol): 448.38 Synonym: Orientin (6CI,7CI,8CI),4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-8-β-D-glucopyranosyl-5,7-dihydroxy-,2-(3,4-Dihydroxyphenyl)-8-β-D-glucopyranosyl-5,7-dihydroxy-4H-1-benzopyran-4-one,8-β-D-Glucopyranosyl-3',4',5,7-tetrahydroxyflavone,Luteolin 8-C-glucoside,Luteolin 8-C-β-D-glucopyranoside,Luteolin 8-C-β-glucopyranoside,Luteolin-8-C-glucoside,Luteolin-8-glucoside,Lutexin,Orientin (flavone) IUPAC Name: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one SMILES: OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c2c(O)cc(O)c3C(=O)C=C(Oc23)c4ccc(O)c(O)c4
Hidiosmin, TRC
CAS: 115960-14-0 Molecular Formula: C30H36O16 Molecular Weight (g/mol): 652.6 Synonym: 7-[[6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-5-(2-hydroxyethoxy)-2-(3-hydroxy-4-methoxyphenyl)-4H-1-benzopyran-4-one,5-O-(beta-Hydroxyethyl)diosmin IUPAC Name: 5-(2-hydroxyethoxy)-2-(3-hydroxy-4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one SMILES: COc1ccc(cc1O)C2=CC(=O)c3c(OCCO)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3O2
(+)-Gallocatechin, TRC
CAS: 970-73-0 Molecular Formula: C15H14O7 Molecular Weight (g/mol): 306.27 Synonym: 2H-1-Benzopyran-3,5,7-triol, 3,4-dihydro-2-(3,4,5-trihydroxyphenyl)-, (2R-trans)-,Gallocatechol (8CI),Gallocatechol, d- (6CI),(2R,3S)-3,4-Dihydro-2-(3,4,5-trihydroxyphenyl)-2H-1-benzopyran-3,5,7-triol,(+)-Gallocatechin,(+)-Gallocatechol,(2R,3S)-(+)-Gallocatechin,Gallocatechin,NSC 674038,Sunphenon EGC-OP,d-Gallocatechin,Gallocatechol,(+)-gallocatechol,D-Gallocatechin; IUPAC Name: (2R,3S)-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol SMILES: O[C@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3cc(O)c(O)c(O)c3
Pinobanksin, TRC
CAS: 548-82-3 Molecular Formula: C15H12O5 Molecular Weight (g/mol): 272.25 Synonym: (2R,3R)-2,3-Dihydro-3,5,7-trihydroxy-2-phenyl-4H-1-benzopyran-4-one,(2R-trans)-2,3-Dihydro-3,5,7-trihydroxy-2-phenyl-4H-1-benzopyran-4-one,3,5,7-Trihydroxyflavanone,(2R,3R)-Pinobanksin,3,5,7-Trihydroxyflavanone,Dihydrogalangin IUPAC Name: (2R,3R)-3,5,7-trihydroxy-2-phenyl-2,3-dihydrochromen-4-one SMILES: O[C@@H]1[C@H](Oc2cc(O)cc(O)c2C1=O)c3ccccc3
(+)-Catechin, TRC
CAS: 154-23-4 Molecular Formula: C15 H14 O6 Molecular Weight (g/mol): 290.27 Synonym: (+)-Catechin,2H-1-Benzopyran-3,5,7-triol, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-, (2R-trans)-,Catechol (8CI),(2R,3S)-2-(3,4-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol,(+)-(2R,3S)-2-(3,4-Dihydroxyphenyl)-3,4-dihydro-1(2H)-benzopyran-3,5,7-triol,(+)-(2R:3S)-5,7,3',4'-Tetrahydroxyflavan-3-ol,(+)-3',4',5,7-Tetrahydroxy-2,3-trans-flavan-3-ol,(+)-Catechin,(+)-Catechol,(+)-Cianidanol,(+)-Cyanidan-3-ol,(+)-Cyanidanol,(+)-Cyanidanol-3,(2R,3S)-(+)-Catechin,3-Cyanidanol, (+)-,Biocatechin,Catechin,Catechin (flavan),Catechinic acid,Catechol (flavan),Catechuic acid,Catergen,Cianidanol,Cyanidanol,Cyanidol,D-(+)-Catechin,D-Catechin,D-Catechol,Dexcyanidanol,HB-MC-TS 35,NSC 2819,P 70A,Sunkatol No. 1,Sunphenon 90,Teafuran 30A,Teafuran 30E,d-Catechin,trans-(+)-3,3',4',5,7-Flavanpentol IUPAC Name: (2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol SMILES: O[C@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3ccc(O)c(O)c3
Linarine, TRC
CAS: 480-36-4 Molecular Formula: C28 H32 O14 Molecular Weight (g/mol): 592.545 Synonym: Linarin,4H-1-Benzopyran-4-one, 7-[[6-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-5-hydroxy-2-(4-methoxyphenyl)-,Linarin (6CI,7CI,8CI),5-Hydroxy-4'-methoxyflavone-7-O-rutinoside,7-[[6-O-(6-Deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-5- IUPAC Name: 5-hydroxy-2-(4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one SMILES: COc1ccc(cc1)C2=CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3O2
Isoquercitroside, TRC
CAS: 21637-25-2 Molecular Formula: C21 H20 O12 Molecular Weight (g/mol): 464.38 Synonym: 2-(3,4-Dihydroxyphenyl)-3-(β-D-glucofuranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one,3,3',4',5,7-Pentahydroxyflavone 3-β-D-glucofuranoside,Isoquercitrin,Isoquercitroside,Isotrifoliin,Quercetin 3-(β-D-glucofuranoside),Quercetin 3-O-β-D-glucofuranoside IUPAC Name: 3-[(2S,4R,5R)-5-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxyoxolan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one SMILES: OC[C@@H](O)[C@H]1O[C@@H](OC2=C(Oc3cc(O)cc(O)c3C2=O)c4ccc(O)c(O)c4)C(O)[C@H]1O
Apiin, TRC
CAS: 26544-34-3 Molecular Formula: C26 H28 O14 Molecular Weight (g/mol): 564.49 Synonym: Apigenin 7-O-β-D-apiofuranosyl(1→2)-β-D-glucopyranoside,7-[(2-O-D-apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-Benzopyran-4-one; IUPAC Name: 7-[(2S,3R,4S,5S,6R)-3-[(2S,3S,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)chromen-4-one SMILES: OC[C@H]1O[C@@H](Oc2cc(O)c3C(=O)C=C(Oc3c2)c4ccc(O)cc4)[C@H](O[C@@H]5OC[C@](O)(CO)[C@@H]5O)[C@@H](O)[C@@H]1O
Casticin, TRC
CAS: 479-91-4 Molecular Formula: C19 H18 O8 Molecular Weight (g/mol): 374.34 Synonym: 4H-1-Benzopyran-4-one, 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,7-trimethoxy-,Casticin (6CI),Flavone, 3',5-dihydroxy-3,4',6,7-tetramethoxy- (7CI,8CI),3,6,7,4'-Tetra-O-methyl-5,3'-dihydroxyflavone,3,6,7,4'-Tetra-O-methylquercetagetin,5,12-Dihydroxy-2,6,7,13-tetramethoxyflavone,5,3'-Dihydroxy-3,6,7,4'-tetramethoxyflavone,5-Hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,7-trimethoxy-4H-1-benzopyran-4-one,Casticine,Quercetagetin 3,6,7,4'-tetramethyl ether,Vitexicarpin IUPAC Name: 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,7-trimethoxychromen-4-one SMILES: COC1=C(Oc2cc(OC)c(OC)c(O)c2C1=O)c3ccc(OC)c(O)c3
(-)-Epigallocatechin, TRC
CAS: 970-74-1 Molecular Formula: C15 H14 O7 Molecular Weight (g/mol): 306.27 Synonym: 2H-1-Benzopyran-3,5,7-triol, 3,4-dihydro-2-(3,4,5-trihydroxyphenyl)-, (2R-cis)-,Epigallocatechol (8CI),Gallocatechol, l- (6CI),(2R,3R)-3,4-Dihydro-2-(3,4,5-trihydroxyphenyl)-2H-1-benzopyran-3,5,7-triol,(-)-3,3',4',5,5',7-Flavanhexol,(-)-Epigallocatechin,(-)-Epigallocatechol,(-)-epi-Gallocatechin,(2R,3R)-2-(3,4,5-Trihydroxyphenyl)-3,5,7-trihydroxychroman,1-epi-3',4',5',5,7-Pentahydroxy-3-flavanol,3,3',4',5,5',7-Flavanhexol,Antiscurvy factor C2,EGC,Epigallocatechin,Factor C2 (antiscurvy),Galloepicatechin,L-Epigallocatechin,NSC 674039,Sunphenon EGC,epi-Gallocatechin,l-Epigallocatechin,l-Epigallocatechol IUPAC Name: (2R,3R)-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol SMILES: O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3cc(O)c(O)c(O)c3
Neoponcirin, TRC
CAS: 14259-47-3 Molecular Formula: C28 H34 O14 Molecular Weight (g/mol): 594.56 Synonym: 4H-1-Benzopyran-4-one, 7-[[6-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(4-methoxyphenyl)-, (2S)-,4H-1-Benzopyran-4-one, 7-[[6-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(4-methoxyphenyl)-, (S)-,Didymin (8CI),Flavanone, 5,7-dihydroxy-4'-methoxy-, 7β-rutinoside (7CI),(2S)-7-[[6-O-(6-Deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one,4'-Methoxy-5,7-dihydroxyflavanone 7-O-rutinoside,Didymine,Isosakuranetin 7-O-rutinoside,Isosakuranetin 7-rutinoside,Neoponcirin IUPAC Name: (2S)-5-hydroxy-2-(4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one SMILES: COc1ccc(cc1)[C@@H]2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3O2
Kaempferide, TRC
CAS: 491-54-3 Molecular Formula: C16 H12 O6 Molecular Weight (g/mol): 300.26 Synonym: 4H-1-Benzopyran-4-one, 3,5,7-trihydroxy-2-(4-methoxyphenyl)-,Flavone, 3,5,7-trihydroxy-4'-methoxy- (7CI,8CI),Kaempferide (6CI),3,5,7-Trihydroxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one,3,5,7-Trihydroxy-4'-methoxyflavone,4'-Methoxykaempferol,4'-Methylkaempferol,4'-O-Methylkaempferol,4'-O-Methylkaempherol,5,7-Dihydroxy-4'-methoxyflavonol,Kaempferid,Kaempferol 4'-O-methyl ether,Kaempferol 4'-methyl ether,Kaempherol 4'-O-methyl ether,NSC 407294 IUPAC Name: 3,5,7-trihydroxy-2-(4-methoxyphenyl)chromen-4-one SMILES: COc1ccc(cc1)C2=C(O)C(=O)c3c(O)cc(O)cc3O2
Myricetin, TRC
CAS: 529-44-2 Molecular Formula: C15 H10 O8 Molecular Weight (g/mol): 318.24 Synonym: Flavone, 3,3',4',5,5',7-hexahydroxy- (8CI),3,5,7-Trihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-1-benzopyran-4-one,3,3',4',5,5',7-Hexahydroxyflavone,3,5,7,3',4',5'-Hexahydroxyflavone,3,5,7-Trihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-one,3,5,7-Trihydroxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one,Cannabiscetin,LDN 0014058,Myricetin,Myricetol,NCBI 5281672,NSC 407290,4H-1-Benzopyran-4-one, 3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)- IUPAC Name: 3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one SMILES: OC1=C(Oc2cc(O)cc(O)c2C1=O)c3cc(O)c(O)c(O)c3
Jaceosidin, TRC
CAS: 18085-97-7 Molecular Formula: C17H14O7 Molecular Weight (g/mol): 330.29 Synonym: 4',5,7-Trihydroxy-3',6-dimethoxy-flavone,5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-methoxy-4H-1-benzopyran-4-one,3',6-Dimethoxy-4',5,7-trihydroxyflavone,4',5,7-Trihydroxy-3',6-dimethoxyflavone,4'-Demethyleupatilin,5,7,4'-Trihydroxy-6,3'-dimethoxyflavone; IUPAC Name: 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-methoxychromen-4-one SMILES: COc1cc(ccc1O)C2=CC(=O)c3c(O)c(OC)c(O)cc3O2