按“信号通路”分类 - 小分子和化合物库 | 纯度: ≥96%, ≥99 atom% 13C, ≥98%(HPLC)

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阿帕芬特
- ≥98%(HPLC)
CAS号 : 105219-56-5 Compound CID : 65889

分子式: C₂₂H₂₂ClN₅O₂S 分子量: 455.96

IUPAC Name: 3-[7-(2-chlorophenyl)-13-methyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-4-yl]-1-morpholin-4-ylpropan-1-one

SMILES: CC1=NN=C2N1C3=C(C=C(S3)CCC(=O)N4CCOCC4)C(=NC2)C5=CC=CC=C5Cl

InChIKey: JGPJQFOROWSRRS-UHFFFAOYSA-N

InChI: InChI=1S/C22H22ClN5O2S/c1-14-25-26-19-13-24-21(16-4-2-3-5-18(16)23)17-12-15(31-22(17)28(14)19)6-7-20(29)27-8-10-30-11-9-27/h2-5,12H,6-11,13H2,1H3
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DL-α-氨基己二酸
- ≥96%
CAS号 : 542-32-5 Compound CID : 469

分子式: C₆H₁₁NO₄ 分子量: 161.16

IUPAC Name: 2-aminohexanedioic acid

SMILES: C(CC(C(=O)O)N)CC(=O)O

InChIKey: OYIFNHCXNCRBQI-UHFFFAOYSA-N

InChI: InChI=1S/C6H11NO4/c7-4(6(10)11)2-1-3-5(8)9/h4H,1-3,7H2,(H,8,9)(H,10,11)
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双(2-乙己基)磺基丁二酸钠（AOT）
- ≥96%
CAS号 : 577-11-7 Compound CID : 23673837

分子式: C₂₀H₃₇NaO₇S 分子量: 444.56

IUPAC Name: sodium;1,4-bis(2-ethylhexoxy)-1,4-dioxobutane-2-sulfonate

SMILES: CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-].[Na+]

InChIKey: APSBXTVYXVQYAB-UHFFFAOYSA-M

InChI: InChI=1S/C20H38O7S.Na/c1-5-9-11-16(7-3)14-26-19(21)13-18(28(23,24)25)20(22)27-15-17(8-4)12-10-6-2;/h16-18H,5-15H2,1-4H3,(H,23,24,25);/q;+1/p-1
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(+)-假木贼碱盐酸盐
- ≥96%
CAS号 : 53912-89-3

分子式: C₁₀H₁₅ClN₂ 分子量: 198.69

IUPAC Name: 3-[(2S)-piperidin-2-yl]pyridine;hydrochloride

SMILES: C1CCNC(C1)C2=CN=CC=C2.Cl

InChIKey: VTMZQNZVYCJLGG-PPHPATTJSA-N

InChI: InChI=1S/C10H14N2.ClH/c1-2-7-12-10(5-1)9-4-3-6-11-8-9;/h3-4,6,8,10,12H,1-2,5,7H2;1H/t10-;/m0./s1
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阿塞那平
- ≥96%
CAS号 : 65576-45-6 Compound CID : 163091

分子式: C₁₇H₁₆ClNO 分子量: 285.77

IUPAC Name: (2S,6S)-9-chloro-4-methyl-13-oxa-4-azatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),7(12),8,10,14,16-hexaene

SMILES: CN1CC2C(C1)C3=C(C=CC(=C3)Cl)OC4=CC=CC=C24

InChIKey: VSWBSWWIRNCQIJ-HUUCEWRRSA-N

InChI: InChI=1S/C17H16ClNO/c1-19-9-14-12-4-2-3-5-16(12)20-17-7-6-11(18)8-13(17)15(14)10-19/h2-8,14-15H,9-10H2,1H3/t14-,15-/m1/s1
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氧化苦参碱
- ≥98%(HPLC)
CAS号 : 16837-52-8

分子式: C₁₅H₂₄N₂O₂ 分子量: 264.36

IUPAC Name: (1R,2R,9S,17S)-13-oxido-7-aza-13-azoniatetracyclo[7.7.1.02,7.013,17]heptadecan-6-one

SMILES: C1CC2C3CCC[N+]4(C3C(CCC4)CN2C(=O)C1)[O-]

InChIKey: XVPBINOPNYFXID-LHDUFFHYSA-N

InChI: InChI=1S/C15H24N2O2/c18-14-7-1-6-13-12-5-3-9-17(19)8-2-4-11(15(12)17)10-16(13)14/h11-13,15H,1-10H2/t11-,12+,13+,15-,17?/m0/s1
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氨苄青霉素，三水
- ≥96%
CAS号 : 7177-48-2 Compound CID : 23565

分子式: C₁₆H₁₉N₃O₄S·3H₂O 分子量: 403.45

IUPAC Name: (2S,5R,6R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid;trihydrate

SMILES: CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)N)C(=O)O)C.O.O.O

InChIKey: RXDALBZNGVATNY-CWLIKTDRSA-N

InChI: InChI=1S/C16H19N3O4S.3H2O/c1-16(2)11(15(22)23)19-13(21)10(14(19)24-16)18-12(20)9(17)8-6-4-3-5-7-8;;;/h3-7,9-11,14H,17H2,1-2H3,(H,18,20)(H,22,23);3*1H2/t9-,10-,11+,14-;;;/m1.../s1
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对乙酰氨基苯酚
- ≥98%(HPLC)
CAS号 : 103-90-2 Compound CID : 1983

分子式: C₈H₉NO₂ 分子量: 151.16

IUPAC Name: N-(4-hydroxyphenyl)acetamide

SMILES: CC(=O)NC1=CC=C(C=C1)O

InChIKey: RZVAJINKPMORJF-UHFFFAOYSA-N

InChI: InChI=1S/C8H9NO2/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10)
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虾青素
- ≥98%(HPLC)
- mixture of cis and trans
CAS号 : 472-61-7 Compound CID : 5281224

分子式: C₄₀H₅₂O₄ 分子量: 596.84

IUPAC Name: (6S)-6-hydroxy-3-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(4S)-4-hydroxy-2,6,6-trimethyl-3-oxocyclohexen-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-2,4,4-trimethylcyclohex-2-en-1-one

SMILES: CC1=C(C(CC(C1=O)O)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2=C(C(=O)C(CC2(C)C)O)C)C)C

InChIKey: MQZIGYBFDRPAKN-UWFIBFSHSA-N

InChI: InChI=1S/C40H52O4/c1-27(17-13-19-29(3)21-23-33-31(5)37(43)35(41)25-39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)38(44)36(42)26-40(34,9)10/h11-24,35-36,41-42H,25-26H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,27-15+,28-16+,29-19+,30-20+/t35-,36-/m0/s1
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阿塞那平马来酸盐
- ≥98%(HPLC)
CAS号 : 85650-56-2 Compound CID : 6917875

分子式: C₁₇H₁₆ClNO ·C₄H₄O₄ 分子量: 401.84

IUPAC Name: (Z)-but-2-enedioic acid;(2S,6S)-9-chloro-4-methyl-13-oxa-4-azatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),7(12),8,10,14,16-hexaene

SMILES: CN1CC2C(C1)C3=C(C=CC(=C3)Cl)OC4=CC=CC=C24.C(=CC(=O)O)C(=O)O

InChIKey: GMDCDXMAFMEDAG-CHHFXETESA-N

InChI: InChI=1S/C17H16ClNO.C4H4O4/c1-19-9-14-12-4-2-3-5-16(12)20-17-7-6-11(18)8-13(17)15(14)10-19;5-3(6)1-2-4(7)8/h2-8,14-15H,9-10H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t14-,15-;/m1./s1
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盐酸胺苯吖啶
- ≥98%(HPLC)
CAS号 : 54301-15-4 Compound CID : 148673

分子式: C₂₁H₁₉N₃O₃S·HCl 分子量: 429.92

IUPAC Name: N-[4-(acridin-9-ylamino)-3-methoxyphenyl]methanesulfonamide;hydrochloride

SMILES: COC1=C(C=CC(=C1)NS(=O)(=O)C)NC2=C3C=CC=CC3=NC4=CC=CC=C42.Cl

InChIKey: WDISRLXRMMTXEV-UHFFFAOYSA-N

InChI: InChI=1S/C21H19N3O3S.ClH/c1-27-20-13-14(24-28(2,25)26)11-12-19(20)23-21-15-7-3-5-9-17(15)22-18-10-6-4-8-16(18)21;/h3-13,24H,1-2H3,(H,22,23);1H
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芹菜素
- ≥98%(HPLC)
CAS号 : 520-36-5 Compound CID : 5280443

分子式: C₁₅H₁₀O₅ 分子量: 270.24

IUPAC Name: 5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one

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

InChIKey: KZNIFHPLKGYRTM-UHFFFAOYSA-N

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