Reference Materials-Aladdin Scientific

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Bisphenol A, Antagonist of Androgen receptor;Agonist of Estrogen receptor-β
- for pharmaceutical anlysis
Cas#: 80-05-7 Compound CID: 6623

Formula: C₁₅H₁₆O₂ Molecular Weight: 228.29

IUPAC Name: 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol

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

InChIKey: IISBACLAFKSPIT-UHFFFAOYSA-N

InChI: InChI=1S/C15H16O2/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12/h3-10,16-17H,1-2H3

Synonyms: Bis(4-hydroxyphenyl) dimethylmethane | bis-phenol-a | Bisphenol-A | DTXCID30182 | 4,2-propane | 4,4'-Dihydroxdiphenyl...
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Tamoxifen, Agonist of Estrogen receptor-α;Antagonist of Estrogen receptor-α;Agonist of Estrogen receptor-β;Antagonist of Estrogen receptor-β;Agonist of GPER
- ≥99%(HPLC)
Cas#: 10540-29-1

Formula: C₂₆H₂₉NO Molecular Weight: 371.51

IUPAC Name: 2-[4-[(Z)-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethylethanamine

SMILES: CCC(=C(C1=CC=CC=C1)C2=CC=C(C=C2)OCCN(C)C)C3=CC=CC=C3

InChIKey: NKANXQFJJICGDU-QPLCGJKRSA-N

InChI: InChI=1S/C26H29NO/c1-4-25(21-11-7-5-8-12-21)26(22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3/h5-18H,4,19-20H2,1-3H3/b26-25-

Synonyms: (Z)-Tamoxifen | ICI 47699 | trans-Tamoxifen
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Tanshinone IIA
- ≥99%
Cas#: 568-72-9 Compound CID: 164676

Formula: C₁₉H₁₈O₃ Molecular Weight: 294.34

IUPAC Name: 1,6,6-trimethyl-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-10,11-dione

SMILES: CC1=COC2=C1C(=O)C(=O)C3=C2C=CC4=C3CCCC4(C)C

InChIKey: HYXITZLLTYIPOF-UHFFFAOYSA-N

InChI: InChI=1S/C19H18O3/c1-10-9-22-18-12-6-7-13-11(5-4-8-19(13,2)3)15(12)17(21)16(20)14(10)18/h6-7,9H,4-5,8H2,1-3H3

Synonyms: CHEBI:108595 | KBio2_000317 | NCGC00095709-04 | Phenanthro[1,11-dione, 6,7,8,9-tetrahydro-1,6,6-trimethyl- | MLS00601...
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Genistein, Activator of CFTR;Agonist of Estrogen receptor-β;Agonist of Estrogen-related receptor-α;Agonist of Estrogen-related receptor-β;Agonist of Estrogen-related receptor-γ;Agonist of TAS2R14;Agonist of TAS2R39;Activator of TRPC5
- ≥98%
Cas#: 446-72-0 Compound CID: 5280961

Formula: C₁₅H₁₀O₅ Molecular Weight: 270.24

IUPAC Name: 5,7-dihydroxy-3-(4-hydroxyphenyl)chromen-4-one

SMILES: C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)O)O

InChIKey: TZBJGXHYKVUXJN-UHFFFAOYSA-N

InChI: InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19/h1-7,16-18H

Synonyms: cid_5280961 | GTPL2826 | BRN 0263823 | DH2M523P0H | MolMap_000022 | GENISTEIN (USP-RS) | Differenol A | GENISTEIN [MI...
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Celastrol, Inhibitor of regulator of G-protein signaling 17
- ≥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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(-)-Epigallocatechin gallate
Cas#: 989-51-5 Compound CID: 65064

Formula: C₂₂H₁₈O₁₁ Molecular Weight: 458.37

IUPAC Name: [(2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate

SMILES: C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O

InChIKey: WMBWREPUVVBILR-WIYYLYMNSA-N

InChI: InChI=1S/C22H18O11/c23-10-5-12(24)11-7-18(33-22(31)9-3-15(27)20(30)16(28)4-9)21(32-17(11)6-10)8-1-13(25)19(29)14(26)2-8/h1-6,18,21,23-30H,7H2/t18-,21-/m1/s1

Synonyms: EGCG | 3-O-Gallate
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Biochanin A, Agonist of Estrogen-related receptor-α;Agonist of Estrogen-related receptor-β;Agonist of Estrogen-related receptor-γ
Cas#: 491-80-5 Compound CID: 5280373

Formula: C₁₆H₁₂O₅ Molecular Weight: 284.26

IUPAC Name: 5,7-dihydroxy-3-(4-methoxyphenyl)chromen-4-one

SMILES: COC1=CC=C(C=C1)C2=COC3=CC(=CC(=C3C2=O)O)O

InChIKey: WUADCCWRTIWANL-UHFFFAOYSA-N

InChI: InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)12-8-21-14-7-10(17)6-13(18)15(14)16(12)19/h2-8,17-18H,1H3

Synonyms: 5,7-Dihydrox -4'-methoxyisoflavone | B4098 | IDI1_001027 | KBio1_001027 | NCGC00017369-01 | Opera_ID_621 | Tox21_3029...
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Chelerythrine chloride
- ≥98%
Cas#: 3895-92-9

Formula: C₂₁H₁₈NO₄.Cl Molecular Weight: 383.82

IUPAC Name: 1,2-dimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium;chloride

SMILES: C[N+]1=C2C(=C3C=CC(=C(C3=C1)OC)OC)C=CC4=CC5=C(C=C42)OCO5.[Cl-]

InChIKey: WEEFNMFMNMASJY-UHFFFAOYSA-M

InChI: InChI=1S/C21H18NO4.ClH/c1-22-10-16-13(6-7-17(23-2)21(16)24-3)14-5-4-12-8-18-19(26-11-25-18)9-15(12)20(14)22;/h4-10H,11H2,1-3H3;1H/q+1;/p-1

Synonyms: Chelerythrine hydrochloride | Q-200825 | SR-01000075750 | UNII-7IC98TZ0PZ | BCP0726000282 | CHELERYTHRINIUM CHLORIDE ...
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