WHO基本药物配体 - 小分子和化合物库

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他莫西芬
- ≥99%(HPLC)
CAS号 : 10540-29-1

分子式: C₂₆H₂₉NO 分子量: 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-
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炔雌醇
- ≥98%
CAS号 : 57-63-6 Compound CID : 5991

分子式: C₂₀H₂₄O₂ 分子量: 296.4

IUPAC Name: (8R,9S,13S,14S,17R)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol

SMILES: CC12CCC3C(C1CCC2(C#C)O)CCC4=C3C=CC(=C4)O

InChIKey: BFPYWIDHMRZLRN-SLHNCBLASA-N

InChI: InChI=1S/C20H24O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,5,7,12,16-18,21-22H,4,6,8-11H2,2H3/t16-,17-,18+,19+,20+/m1/s1
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DL-肾上腺素（肾上腺素）
- ≥98%
CAS号 : 329-65-7 Compound CID : 838

分子式: C₉H₁₃NO₃ 分子量: 183.2

IUPAC Name: 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol

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

InChIKey: UCTWMZQNUQWSLP-UHFFFAOYSA-N

InChI: InChI=1S/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3
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酒石酸福莫特罗
CAS号 : 73573-87-2 Compound CID : 3410

分子式: 19H24N2O4

IUPAC Name: N-[2-hydroxy-5-[1-hydroxy-2-[1-(4-methoxyphenyl)propan-2-ylamino]ethyl]phenyl]formamide

SMILES: CC(CC1=CC=C(C=C1)OC)NCC(C2=CC(=C(C=C2)O)NC=O)O

InChIKey: BPZSYCZIITTYBL-UHFFFAOYSA-N

InChI: InChI=1S/C19H24N2O4/c1-13(9-14-3-6-16(25-2)7-4-14)20-11-19(24)15-5-8-18(23)17(10-15)21-12-22/h3-8,10,12-13,19-20,23-24H,9,11H2,1-2H3,(H,21,22)
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比索洛尔
- ≥98%
CAS号 : 66722-44-9 Compound CID : 2405

分子式: C₁₈H₃₁NO₄ 分子量: 325.44

IUPAC Name: 1-(propan-2-ylamino)-3-[4-(2-propan-2-yloxyethoxymethyl)phenoxy]propan-2-ol

SMILES: CC(C)NCC(COC1=CC=C(C=C1)COCCOC(C)C)O

InChIKey: VHYCDWMUTMEGQY-UHFFFAOYSA-N

InChI: InChI=1S/C18H31NO4/c1-14(2)19-11-17(20)13-23-18-7-5-16(6-8-18)12-21-9-10-22-15(3)4/h5-8,14-15,17,19-20H,9-13H2,1-4H3
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