Labeled Ligands
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3-Indoleacetic acid-d5Cas#: 76937-78-5(DMSO)Formula: C10H4D5NO2 Molecular Weight: 180.21SMILES: C1=CC=C2C(=C1)C(=CN2)CC(=O)O
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(Rac)-1,2-Bis-palmitol-3-chloropropanediol-d5Cas#: 1185057-55-9 Compound CID: 45038378Formula: C35H62D5ClO4 Molecular Weight: 592.39SMILES: [2H]C([2H])(C([2H])(C([2H])([2H])Cl)OC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC
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3-Indoleacetic acid-d5Cas#: 76937-78-5 Compound CID: 54301591Formula: C10H4D5NO2 Molecular Weight: 180.21IUPAC Name: 2-(2,4,5,6,7-pentadeuterio-1H-indol-3-yl)acetic acidSMILES: C1=CC=C2C(=C1)C(=CN2)CC(=O)OInChIKey: SEOVTRFCIGRIMH-SNOLXCFTSA-NInChI: InChI=1S/C10H9NO2/c12-10(13)5-7-6-11-9-4-2-1-3-8(7)9/h1-4,6,11H,5H2,(H,12,13)/i1D,2D,3D,4D,6DSynonyms: Indole-2,4,5,6,7-d5-3-acetic acid, 98 atom % D, 98% (CP) | HY-18569S | SCHEMBL1332218 | 3-Indoleacetic acid-D5 | D987...
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Juvenile Hormone III-d3Cas#: 951116-89-5Formula: C16H23D3O3\n Molecular Weight: 269.39SMILES: [2H]C([2H])([2H])OC(/C=C(C)/CC/C=C(C)/CCC1C(C)(O1)C)=O
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DL-3-Phenylalanine-2-13CCas#: 64193-01-7Formula: C6H5CH213CH(NH2)CO2H Molecular Weight: 166.18IUPAC Name: phenyl (2S)-2-amino(213C)propanoateSMILES: CC(C(=O)OC1=CC=CC=C1)NInChIKey: HCRMTRJXSDDOIK-DYQYKUGJSA-NInChI: InChI=1S/C9H11NO2/c1-7(10)9(11)12-8-5-3-2-4-6-8/h2-7H,10H2,1H3/t7-/m0/s1/i7+1Synonyms: DL-3-Phenylalanine-¹³C-1
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Retinol-d5Cas#: 1185244-58-9 Compound CID: 45040357Formula: C20H25D5O Molecular Weight: 291.48IUPAC Name: (2E,4E,6E,8E)-9-[3,3-dideuterio-6,6-dimethyl-2-(trideuteriomethyl)cyclohexen-1-yl]-3,7-dimethylnona-2,4,6,8-tetraen-1-olSMILES: CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CCO)C)CInChIKey: FPIPGXGPPPQFEQ-LHAZDGMOSA-NInChI: InChI=1S/C20H30O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6,8-9,11-13,21H,7,10,14-15H2,1-5H3/b9-6+,12-11+,16-8+,17-13+/i3D3,10D2
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(Aminomethyl)phosphonic acid-d2Cas#: 30926-24-0Formula: CH4D2NO3P Molecular Weight: 113.05SMILES: NC([2H])([2H])P(O)(O)=O
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Aspartame-d5Cas#: 1356849-17-6 Compound CID: 46780484Formula: C14H13D5N2O5 Molecular Weight: 299.33IUPAC Name: (3S)-3-amino-4-[[(2S)-1-methoxy-1-oxo-3-(2,3,4,5,6-pentadeuteriophenyl)propan-2-yl]amino]-4-oxobutanoic acidSMILES: COC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC(=O)O)NInChIKey: IAOZJIPTCAWIRG-HEPISUNPSA-NInChI: InChI=1S/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18/h2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18)/t10-,11-/m0/s1/i2D,3D,4D,5D,6DSynonyms: Methyl L-alpha-aspartyl-L-(2,3,4,5,6-~2~H_5_)phenylalaninate | 1356849-17-6 | J-006750 | Aspartame-d5 | CS-0202248 | ...
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(Rac)-3-Aminoisobutyric acid-d3hydrochlorideCas#: 1346602-62-7 Compound CID: 71313267Formula: C4H7D3ClNO2 Molecular Weight: 142.6IUPAC Name: 2-(aminomethyl)-3,3,3-trideuteriopropanoic acid;hydrochlorideSMILES: CC(CN)C(=O)O.ClInChIKey: CGGBOMJVYQTWRN-NIIDSAIPSA-NInChI: InChI=1S/C4H9NO2.ClH/c1-3(2-5)4(6)7;/h3H,2,5H2,1H3,(H,6,7);1H/i1D3;
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L-Carnitine-d3hydrochlorideCas#: 350818-62-1 Compound CID: 71309656Formula: C7H13D3ClNO3 Molecular Weight: 200.68IUPAC Name: [(2R)-3-carboxy-2-hydroxypropyl]-dimethyl-(trideuteriomethyl)azanium;chlorideSMILES: C[N+](C)(C)CC(CC(=O)O)O.[Cl-]InChIKey: JXXCENBLGFBQJM-QKBJTWEASA-NInChI: InChI=1S/C7H15NO3.ClH/c1-8(2,3)5-6(9)4-7(10)11;/h6,9H,4-5H2,1-3H3;1H/t6-;/m1./s1/i1D3;Synonyms: L-Carnitine-d3 (chloride) | HY-B1453S | L-Carnitine-d3 Chloride | CS-0202855 | DTXSID90745953 | L-CARNITINE-D3 HCL (M...
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L-Alpha-Lysophosphatidylcholine,oleoyl-d7Cas#: 2097561-13-0Formula: C26H45D7NO7P Molecular Weight: 528.71SMILES: [2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])CCCCC/C=C\\CCCCCCCC(OC[C@@H](O)COP(OCC[N+](C)(C)C)([O-])=O)=O
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Ezetimibe-d4Cas#: 1093659-90-5 Compound CID: 25145350Formula: C24H17D4F2NO3 Molecular Weight: 413.45IUPAC Name: (3R,4S)-3-[(3S)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)-1-(2,3,5,6-tetradeuterio-4-fluorophenyl)azetidin-2-oneSMILES: C1=CC(=CC=C1C2C(C(=O)N2C3=CC=C(C=C3)F)CCC(C4=CC=C(C=C4)F)O)OInChIKey: OLNTVTPDXPETLC-ARVCERDTSA-NInChI: InChI=1S/C24H21F2NO3/c25-17-5-1-15(2-6-17)22(29)14-13-21-23(16-3-11-20(28)12-4-16)27(24(21)30)19-9-7-18(26)8-10-19/h1-12,21-23,28-29H,13-14H2/t21-,22+,23-/m1/s1/i7D,8D,9D,10DSynonyms: Sch-58235-d4 | (3R,4S)-3-[(3S)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)-1-(2,3,5,6-tetradeuterio-4-flu...
