Drug Metabolite

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  1. 4-Hydroxytamoxifen
    CAS: 68392-35-8 EC Number: 627-097-8 Formula: C26H29NO2 Molecular Weight: 387.51
    ≥98% E:Z isomers=50:50
    ● In Stock — US warehouse, ships to EU* Item #: H113421
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    IUPAC Name
    4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]-2-phenylbut-1-enyl]phenol
    SMILES
    CCC(=C(C1=CC=C(C=C1)O)C2=CC=C(C=C2)OCCN(C)C)C3=CC=CC=C3
    InChIKey
    TXUZVZSFRXZGTL-QPLCGJKRSA-N
    InChI
    1S/C26H29NO2/c1-4-25(20-8-6-5-7-9-20)26(21-10-14-23(28)15-11-21)22-12-16-24(17-13-22)29-19-18-27(2)3/h5-17,28H,4,18-19H2,1-3H3/b26-25-
    Synonyms
    4-OHT | SR-01000759243 | 4-((1Z)-1-(4-(2-(dimethylamino)ethoxy)phenyl)-2-phenyl-1-butenyl)phenol | 4-OH-TAM | CAS-680...
  2. (2,6-Dimethylphenyl)thiourea
    CAS: 6396-76-5 EC Number: 229-005-8 Formula: C9H12N2S Molecular Weight: 180.27
    Solid ≥97%
    ● In Stock — US warehouse, ships to EU* Item #: D154885
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    IUPAC Name
    (2,6-dimethylphenyl)thiourea
    SMILES
    CC1=C(C(=CC=C1)C)NC(=S)N
    InChIKey
    ASNKJUONFPQYPC-UHFFFAOYSA-N
    InChI
    1S/C9H12N2S/c1-6-4-3-5-7(2)8(6)11-9(10)12/h3-5H,1-2H3,(H3,10,11,12)
    Synonyms
    EINECS 229-005-8 | NSC 202179 | ASNKJUONFPQYPC-UHFFFAOYSA-N | SCHEMBL15880161 | Thiourea, (2,6-dimethylphenyl)- | FT-...
  3. (2S,3R,11bR)-9,10-dimethoxy-3-(2-methylpropyl)-1H,2H,3H,4H,6H,7H,11bH-pyrido[2,1-a]isoquinolin-2-ol
    CAS: 924854-60-4 Formula: C19H29NO3 Molecular Weight: 319.445
    ◐ .Made to order · 8–12 wks Item #: S178250
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    IUPAC Name
    (2S,3R,11bR)-9,10-dimethoxy-3-(2-methylpropyl)-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-ol
    SMILES
    CC(C)CC1CN2CCC3=CC(=C(C=C3C2CC1O)OC)OC
    InChIKey
    WEQLWGNDNRARGE-OIISXLGYSA-N
    InChI
    1S/C19H29NO3/c1-12(2)7-14-11-20-6-5-13-8-18(22-3)19(23-4)9-15(13)16(20)10-17(14)21/h8-9,12,14,16-17,21H,5-7,10-11H2,1-4H3/t14-,16-,17+/m1/s1
    Synonyms
    (2)-Dihydrotetrabenazine-D7 | P16428 | 2H-Benzo(a)quinolizin-2-ol, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-3-(2-methyl...
  4. (2′S)-Nicotine 1-Oxide
    CAS: 2820-55-5 PubChem CID: 211457 Formula: C10H14N20 Molecular Weight: 178.19
    ● In Stock — US warehouse, ships to EU* Item #: S357037
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    IUPAC Name
    3-[(2S)-1-methylpyrrolidin-2-yl]-1-oxidopyridin-1-ium
    SMILES
    CN1CCCC1C2=C[N+](=CC=C2)[O-]
    InChIKey
    YHXKVHQFWVYXIC-JTQLQIEISA-N
    InChI
    1S/C10H14N2O/c1-11-6-3-5-10(11)9-4-2-7-12(13)8-9/h2,4,7-8,10H,3,5-6H2,1H3/t10-/m0/s1
    Synonyms
    (2'S)-Nicotine-1-oxide | UNII-8WQ7L5T6TJ | (S)-nicotine 1-N-oxide | 3-[(2S)-1-methylpyrrolidin-2-yl]-1-oxido-pyridin-...
  5. (±)-Norverapamil hydrochloride
    CAS: 67812-42-4 EC Number: 689-780-7 Formula: C15H15Si Molecular Weight: 477.04
    ◐ .Made to order · 8–12 wks Item #: N135881
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    IUPAC Name
    2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethylamino]-2-propan-2-ylpentanenitrile;hydrochloride
    SMILES
    CC(C)C(CCCNCCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C=C2)OC)OC.Cl
    InChIKey
    OEAFTRIDBHSJDC-UHFFFAOYSA-N
    InChI
    1S/C26H36N2O4.ClH/c1-19(2)26(18-27,21-9-11-23(30-4)25(17-21)32-6)13-7-14-28-15-12-20-8-10-22(29-3)24(16-20)31-5;/h8-11,16-17,19,28H,7,12-15H2,1-6H3;1H
    Synonyms
    NORVERAPAMILHYDROCHLORIDE | BIM-0061759.0001 | 2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethylamino]-2-propan...
  6. 1-Methylxanthine
    CAS: 6136-37-4 EC Number: 228-108-5 Formula: C6H6N4O2 Molecular Weight: 166.14
    ● In Stock — US warehouse, ships to EU* Item #: M123213
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    IUPAC Name
    1-methyl-3,7-dihydropurine-2,6-dione
    SMILES
    CN1C(=O)C2=C(NC1=O)N=CN2
    InChIKey
    MVOYJPOZRLFTCP-UHFFFAOYSA-N
    InChI
    1S/C6H6N4O2/c1-10-5(11)3-4(8-2-7-3)9-6(10)12/h2H,1H3,(H,7,8)(H,9,12)
    Synonyms
    1-Methyl-3,7-dihydro-purine-2,6-dione | 1-methyl-3,7-dihydropurine-2,6-dione | SCHEMBL10996 | 1-Methyl-3,9-dihydro-pu...
  7. 10,11-Dihydrocarbamazepine
    CAS: 3564-73-6 EC Number: 222-649-0 Formula: C15H14N2O Molecular Weight: 238.28
    ● In Stock — US warehouse, ships to EU* Item #: D169870
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    IUPAC Name
    5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide
    SMILES
    C1CC2=CC=CC=C2N(C3=CC=CC=C31)C(=O)N
    InChIKey
    PHNLCHMJDSSPDQ-UHFFFAOYSA-N
    InChI
    1S/C15H14N2O/c16-15(18)17-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)17/h1-8H,9-10H2,(H2,16,18)
    Synonyms
    10,11-Dihydrocarbamazepine | EINECS 222-649-0 | SCHEMBL1744688 | STL450943 | 10,11-Dihydro Carbamazepine | FT-0607181...
  8. 10-Undecen-1-ol
    CAS: 112-43-6 EC Number: 203-971-0 Formula: C11H22O Molecular Weight: 170.29
    ● In Stock — Germany Item #: U106482
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    IUPAC Name
    undec-10-en-1-ol
    SMILES
    C=CCCCCCCCCCO
    InChIKey
    GIEMHYCMBGELGY-UHFFFAOYSA-N
    InChI
    1S/C11H22O/c1-2-3-4-5-6-7-8-9-10-11-12/h2,12H,1,3-11H2
    Synonyms
    omega-Undecylenyl alcohol | 10-Undecylen-1-ol | undec-10-en-1-ol | WLN: Q10U1 | 1-Undecen-11-ol | Q18611668 | omega-u...
  9. 2,6-Dimethylaniline Hydrochloride
    CAS: 21436-98-6 EC Number: 244-388-1 Formula: C8H11N·HCl Molecular Weight: 157.64
    ● In Stock — US warehouse, ships to EU* Item #: D154322
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    IUPAC Name
    2,6-dimethylaniline;hydrochloride
    SMILES
    CC1=C(C(=CC=C1)C)N.Cl
    InChIKey
    QNWMFJDRMZWZNN-UHFFFAOYSA-N
    InChI
    1S/C8H11N.ClH/c1-6-4-3-5-7(2)8(6)9;/h3-5H,9H2,1-2H3;1H
    Synonyms
    AKOS016846160 | 2,6-xylidine hydrochloride | QNWMFJDRMZWZNN-UHFFFAOYSA-N | 2,6-Dimethylaniline hydrochloride, Aldrich...
  10. 2-Imidazolidinetione
    CAS: 96-45-7 EC Number: 202-506-9 Formula: C3H6N2S Molecular Weight: 102.16
    ● In Stock — Germany Item #: I109215
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    Technical Identifiers
    IUPAC Name
    imidazolidine-2-thione
    SMILES
    C1CNC(=S)N1
    InChIKey
    PDQAZBWRQCGBEV-UHFFFAOYSA-N
    InChI
    1S/C3H6N2S/c6-3-4-1-2-5-3/h1-2H2,(H2,4,5,6)
    Synonyms
    2-Imidazolidinethione | 2-imidazolidine-thione | HMS3372A09 | NA-22-D | DTXCID90601 | Ethylene thiourea (ETU) | Imida...
  11. 20-COOH-LTB4
    CAS: 80434-82-8 PubChem CID: 5280877 Formula: C20H30O6 Molecular Weight: 366.45
    ≥97% 100 μg/ml in ethanol
    ◐ .Made to order · 8–12 wks Item #: C353436
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    IUPAC Name
    (5S,6Z,8E,10E,12R,14Z)-5,12-dihydroxyicosa-6,8,10,14-tetraenedioic acid
    SMILES
    C(CCC(=O)O)CC=CCC(C=CC=CC=CC(CCCC(=O)O)O)O
    InChIKey
    SXWGPVJGNOLNHT-VFLUTPEKSA-N
    InChI
    1S/C20H30O6/c21-17(11-6-2-1-3-9-15-19(23)24)12-7-4-5-8-13-18(22)14-10-16-20(25)26/h2,4-8,12-13,17-18,21-22H,1,3,9-11,14-16H2,(H,23,24)(H,25,26)/b5-4+,show more
    Synonyms
    BML1-E06 | HY-113483 | (S-(R*,S*-(E,Z,E,Z)))-5,12-dihydroxy-6,8,10,14-Eicosatetraenedioate | 20-carboxyleukotriene B4...
  12. 3,4,5-Trimethoxyphenylacetic acid
    CAS: 951-82-6 EC Number: 213-456-2 PubChem CID: 70372 Formula: C11H14O5 Molecular Weight: 226.23
    ● In Stock — US warehouse, ships to EU* Item #: T107284
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    Technical Identifiers
    IUPAC Name
    2-(3,4,5-trimethoxyphenyl)acetic acid
    SMILES
    COC1=CC(=CC(=C1OC)OC)CC(=O)O
    InChIKey
    DDSJXCGGOXKGSJ-UHFFFAOYSA-N
    InChI
    1S/C11H14O5/c1-14-8-4-7(6-10(12)13)5-9(15-2)11(8)16-3/h4-5H,6H2,1-3H3,(H,12,13)
    Synonyms
    AM20041458 | Q27216287 | T1105 | AS-15922 | Disodium guanosine-5'-monophosphate | EINECS 213-456-2 | HMS1778L09 | Ben...
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What can I find under Drug Metabolite?
This listing collects compounds associated with Drug Metabolite within our Metabolic Enzyme/Protease area — inhibitors, agonists or antagonists, and reference tool compounds. Each entry links to its structure, CAS number, and reported activity so you can confirm the annotation before ordering.
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Consider the reported potency of each Drug Metabolite compound and the assay behind it, selectivity against closely related targets, cell permeability if you are working in cells, and stability in your buffer. Two chemically distinct compounds giving the same phenotype is much stronger evidence than one.
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Each Drug Metabolite product page lists purity, identity data, molecular formula and weight, and storage conditions, with a lot-specific Certificate of Analysis available. Solubility and handling notes are on the datasheet. All products are supplied for professional research and development use only, and are not for use in humans, animals, diagnostics, or therapy.
Can I search Drug Metabolite compounds by activity or structure?
Yes. Filter the Drug Metabolite listing by mechanism — inhibitor, agonist, antagonist — and search by target name or gene symbol, CAS number, molecular formula, or SMILES to reach exact structures and close analogs. For bulk quantities or items not listed, contact [email protected].

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