Reference Materials-Aladdin Scientific

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Chrysin, Inhibitor of CYP1A1;Inhibitor of CYP1B1

Grade & Purity:

analytical standard

Moligand™

≥98%

Cas#: 480-40-0 Compound CID: 5281607

Formula: C₁₅H₁₀O₄ Molecular Weight: 254.24

IUPAC Name: 5,7-dihydroxy-2-phenylchromen-4-one

SMILES: C1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O

InChIKey: RTIXKCRFFJGDFG-UHFFFAOYSA-N

InChI: InChI=1S/C15H10O4/c16-10-6-11(17)15-12(18)8-13(19-14(15)7-10)9-4-2-1-3-5-9/h1-8,16-17H

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Celastrol, Inhibitor of regulator of G-protein signaling 17

Grade & Purity:

analytical standard

Moligand™

≥98%

Cas#: 34157-83-0 Compound CID: 122724

Formula: C₂₉H₃₈O₄ Molecular Weight: 450.61

IUPAC Name: (2R,4aS,6aR,6aS,14aS,14bR)-10-hydroxy-2,4a,6a,6a,9,14a-hexamethyl-11-oxo-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylic acid

SMILES: CC1=C(C(=O)C=C2C1=CC=C3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C(=O)O)C)C)C)C)O

InChIKey: KQJSQWZMSAGSHN-JJWQIEBTSA-N

InChI: InChI=1S/C29H38O4/c1-17-18-7-8-21-27(4,19(18)15-20(30)23(17)31)12-14-29(6)22-16-26(3,24(32)33)10-9-25(22,2)11-13-28(21,29)5/h7-8,15,22,31H,9-14,16H2,1-6H3,(H,32,33)/t22-,25-,26-,27+,28-,29+/m1/s1

Synonyms: (2R,4aS,6aR,6aS,14aS,14bR)-10-hydroxy-2,4a,6a,6a,9,14a-hexamethyl-11-oxo-1,3,4,5,6,13,14,14b-octahydropicene-2-carbox...

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Hesperitin

Grade & Purity:

analytical standard

Moligand™

≥98%

Cas#: 520-33-2 Compound CID: 72281

Formula: C₁₆H₁₄O₆ Molecular Weight: 302.29

IUPAC Name: (2S)-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydrochromen-4-one

SMILES: COC1=C(C=C(C=C1)C2CC(=O)C3=C(C=C(C=C3O2)O)O)O

InChIKey: AIONOLUJZLIMTK-AWEZNQCLSA-N

InChI: InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1

Synonyms: Hesperitin; Hesperin; YSO2; Prestwick_908 | (2S)-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydro-4H-chromen-4...

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Chrysin

Grade & Purity:

Moligand™

≥98%

Cas#: 480-40-0 Compound CID: 5281607

Formula: C₁₅H₁₀O₄ Molecular Weight: 254.24

IUPAC Name: 5,7-dihydroxy-2-phenylchromen-4-one

SMILES: C1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O

InChIKey: RTIXKCRFFJGDFG-UHFFFAOYSA-N

InChI: InChI=1S/C15H10O4/c16-10-6-11(17)15-12(18)8-13(19-14(15)7-10)9-4-2-1-3-5-9/h1-8,16-17H

Synonyms: 5,7-Dihydroxyflavone | 5,7-dihydroxy-2-phenyl-4H-benzo[b]pyran-4-one

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Daidzein

Grade & Purity:

analytical standard

Moligand™

≥98%

Cas#: 486-66-8 Compound CID: 5281708

Formula: C₁₅H₁₀O₄ Molecular Weight: 254.24

IUPAC Name: 7-hydroxy-3-(4-hydroxyphenyl)chromen-4-one

SMILES: C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O)O

InChIKey: ZQSIJRDFPHDXIC-UHFFFAOYSA-N

InChI: InChI=1S/C15H10O4/c16-10-3-1-9(2-4-10)13-8-19-14-7-11(17)5-6-12(14)15(13)18/h1-8,16-17H

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Lithospermic acid

Grade & Purity:

analytical standard

≥98%

Cas#: 28831-65-4 Compound CID: 6441498

Formula: C₂₇H₂₂O₁₂ Molecular Weight: 538.46

IUPAC Name: (2S,3S)-4-[(E)-3-[(1R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]-3-oxoprop-1-enyl]-2-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-1-benzofuran-3-carboxylic acid

SMILES: C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=C3C(C(OC3=C(C=C2)O)C4=CC(=C(C=C4)O)O)C(=O)O)O)O

InChIKey: UJZQBMQZMKFSRV-RGKBJLTCSA-N

InChI: InChI=1S/C27H22O12/c28-15-5-1-12(9-18(15)31)10-20(26(34)35)38-21(33)8-4-13-2-7-17(30)25-22(13)23(27(36)37)24(39-25)14-3-6-16(29)19(32)11-14/h1-9,11,20,23-24,28-32H,10H2,(H,34,35)(H,36,37)/b8-4+/t20-,23+,24-/m1/s1

Synonyms: (2S,3S)-4-[(1E)-3-[(1R)-1-CARBOXY-2-(3,4-DIHYDROXYPHENYL)ETHOXY]-3-OXOPROP-1-EN-1-YL]-2-(3,4-DIHYDROXYPHENYL)-7-HYDRO...

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Luteolin, Agonist of TAS2R14;Agonist of TAS2R39

Grade & Purity:

analytical standard

Moligand™

≥98%

Cas#: 491-70-3 Compound CID: 5280445

Formula: C₁₅H₁₀O₆ Molecular Weight: 286.24

IUPAC Name: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one

SMILES: C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)O

InChIKey: IQPNAANSBPBGFQ-UHFFFAOYSA-N

InChI: InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H

Synonyms: Digitoflavone | Luteolol | 2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4-one

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Naringenin

Grade & Purity:

analytical standard

≥98%

Cas#: 480-41-1 Compound CID: 439246

Formula: C₁₅H₁₂O₅ Molecular Weight: 272.25

IUPAC Name: (2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

SMILES: C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O

InChIKey: FTVWIRXFELQLPI-ZDUSSCGKSA-N

InChI: InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2/t13-/m0/s1

Synonyms: S-Dihydrogenistein | NSC 34875 | pelargidanon 1602 | Salipurol | NSC 11855

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Quercetin 3-β-D-glucoside

Grade & Purity:

analytical standard

≥98%

Cas#: 482-35-9 Compound CID: 5280804

Formula: C₂₁H₂₀O₁₂ Molecular Weight: 464.38

IUPAC Name: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one

SMILES: C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O

InChIKey: OVSQVDMCBVZWGM-QSOFNFLRSA-N

InChI: InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18-,21+/m1/s1

Synonyms: BRD-K73991644-001-01-7 | Isoquercitrin | 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6...

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