按“信号通路”分类 - 小分子和化合物库 | 纯度: ≥98%(HPLC)(N), ≥75%(HPLC), ≥94%

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胃蛋白酶抑制剂
- ≥75%(HPLC)
CAS号 : 26305-03-3

分子式: C₃₄H₆₃N₅O₉ 分子量: 685.89

IUPAC Name: (3S,4S)-3-hydroxy-4-[[(2S)-2-[[(3S,4S)-3-hydroxy-6-methyl-4-[[(2S)-3-methyl-2-[[(2S)-3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]butanoyl]amino]heptanoyl]amino]propanoyl]amino]-6-methylheptanoic acid

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

InChIKey: FAXGPCHRFPCXOO-LXTPJMTPSA-N

InChI: InChI=1S/C34H63N5O9/c1-17(2)12-23(37-33(47)31(21(9)10)39-34(48)30(20(7)8)38-27(42)14-19(5)6)25(40)15-28(43)35-22(11)32(46)36-24(13-18(3)4)26(41)16-29(44)45/h17-26,30-31,40-41H,12-16H2,1-11H3,(H,35,43)(H,36,46)(H,37,47)(H,38,42)(H,39,48)(H,44,45)/t22-,23-,24-,25-,26-,30-,31-/m0/s1
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碘化丙锭（PI）
- ≥94%
CAS号 : 25535-16-4 Compound CID : 104981

分子式: C₂₇H₃₄I₂N₄ 分子量: 668.39

IUPAC Name: 3-(3,8-diamino-6-phenylphenanthridin-5-ium-5-yl)propyl-diethyl-methylazanium;diiodide

SMILES: CC[N+](C)(CC)CCC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N)N.[I-].[I-]

InChIKey: XJMOSONTPMZWPB-UHFFFAOYSA-M

InChI: InChI=1S/C27H33N4.2HI/c1-4-31(3,5-2)17-9-16-30-26-19-22(29)13-15-24(26)23-14-12-21(28)18-25(23)27(30)20-10-7-6-8-11-20;;/h6-8,10-15,18-19,29H,4-5,9,16-17,28H2,1-3H3;2*1H/q+1;;/p-1
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4,4'-二苯胺基-1,1'-联萘-5,5'-二磺酸二钾盐
- ≥94%
CAS号 : 65664-81-5 Compound CID : 16213473

分子式: C₃₂H₂₂K₂N₂O₆S₂ 分子量: 672.85

IUPAC Name: dipotassium;8-anilino-5-(4-anilino-5-sulfonatonaphthalen-1-yl)naphthalene-1-sulfonate

SMILES: C1=CC=C(C=C1)NC2=C3C(=C(C=C2)C4=C5C=CC=C(C5=C(C=C4)NC6=CC=CC=C6)S(=O)(=O)[O-])C=CC=C3S(=O)(=O)[O-].[K+].[K+]

InChIKey: VWLWTJHKQHRTNC-UHFFFAOYSA-L

InChI: InChI=1S/C32H24N2O6S2.2K/c35-41(36,37)29-15-7-13-25-23(17-19-27(31(25)29)33-21-9-3-1-4-10-21)24-18-20-28(34-22-11-5-2-6-12-22)32-26(24)14-8-16-30(32)42(38,39)40;;/h1-20,33-34H,(H,35,36,37)(H,38,39,40);;/q;2*+1/p-2
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甘草酸二钾水合物
- ≥75%(HPLC)
CAS号 : 68797-35-3 Compound CID : 656852

分子式: C₄₂H₆₀K₂O₁₆·xH₂O 分子量: 899.12(as Anhydrous)

IUPAC Name: dipotassium;(2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-carboxylato-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylate

SMILES: CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)[O-])O)O)OC5C(C(C(C(O5)C(=O)[O-])O)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)C.[K+].[K+]

InChIKey: BIVBRWYINDPWKA-VLQRKCJKSA-L

InChI: InChI=1S/C42H62O16.2K/c1-37(2)21-8-11-42(7)31(20(43)16-18-19-17-39(4,36(53)54)13-12-38(19,3)14-15-41(18,42)6)40(21,5)10-9-22(37)55-35-30(26(47)25(46)29(57-35)33(51)52)58-34-27(48)23(44)24(45)28(56-34)32(49)50;;/h16,19,21-31,34-35,44-48H,8-15,17H2,1-7H3,(H,49,50)(H,51,52)(H,53,54);;/q;2*+1/p-2/t19-,21-,22-,23-,24-,25-,26-,27+,28-,29-,30+,31+,34-,35-,38+,39-,40-,41+,42+;;/m0../s1
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1-苄基-3-苯基硫脲
- ≥98%(HPLC)(N)
CAS号 : 726-25-0

分子式: C₁₄H₁₄N₂S 分子量: 242.34

IUPAC Name: 1-benzyl-3-phenylthiourea

SMILES: C1=CC=C(C=C1)CNC(=S)NC2=CC=CC=C2

InChIKey: NXCBDDGSOXJEFZ-UHFFFAOYSA-N

InChI: InChI=1S/C14H14N2S/c17-14(16-13-9-5-2-6-10-13)15-11-12-7-3-1-4-8-12/h1-10H,11H2,(H2,15,16,17)
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2,6-二甲基苯胺盐酸盐
- ≥98%(HPLC)(N)
CAS号 : 21436-98-6 Compound CID : 88899

分子式: C₈H₁₁N·HCl 分子量: 157.64

IUPAC Name: 2,6-dimethylaniline;hydrochloride

SMILES: CC1=C(C(=CC=C1)C)N.Cl

InChIKey: QNWMFJDRMZWZNN-UHFFFAOYSA-N

InChI: InChI=1S/C8H11N.ClH/c1-6-4-3-5-7(2)8(6)9;/h3-5H,9H2,1-2H3;1H
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6-叔-丁基-2,3-萘二甲腈
- ≥94%
CAS号 : 32703-82-5 Compound CID : 613000

分子式: C₁₆H₁₄N₂ 分子量: 234.3

IUPAC Name: 6-tert-butylnaphthalene-2,3-dicarbonitrile

SMILES: CC(C)(C)C1=CC2=CC(=C(C=C2C=C1)C#N)C#N

InChIKey: MKILROQBJOOZKC-UHFFFAOYSA-N

InChI: InChI=1S/C16H14N2/c1-16(2,3)15-5-4-11-6-13(9-17)14(10-18)7-12(11)8-15/h4-8H,1-3H3
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(-)-假木贼碱
- ≥94%
CAS号 : 494-52-0

分子式: C₁₀H₁₄N₂ 分子量: 162.23

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

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

InChIKey: MTXSIJUGVMTTMU-JTQLQIEISA-N

InChI: InChI=1S/C10H14N2/c1-2-7-12-10(5-1)9-4-3-6-11-8-9/h3-4,6,8,10,12H,1-2,5,7H2/t10-/m0/s1
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富马酸亚铁
- ≥94%
CAS号 : 141-01-5 Compound CID : 6433164

分子式: C₄H₂FeO₄ 分子量: 169.9

IUPAC Name: (E)-but-2-enedioate;iron(2+)

SMILES: C(=CC(=O)[O-])C(=O)[O-].[Fe+2]

InChIKey: PMVSDNDAUGGCCE-TYYBGVCCSA-L

InChI: InChI=1S/C4H4O4.Fe/c5-3(6)1-2-4(7)8;/h1-2H,(H,5,6)(H,7,8);/q;+2/p-2/b2-1+;
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NF023,竞争性P2X 1受体拮抗剂
- ≥94%
CAS号 : 104869-31-0 Compound CID : 53249227

分子式: C₃₅H₂₀N₄Na₆O₂₁S₆·12·5H₂O 分子量: 1388.02

SMILES: C1=CC(=CC(=C1)NC(=O)NC2=CC=CC(=C2)C(=O)NC3=C4C(=CC(=CC4=C(C=C3)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)C(=O)NC5=C6C(=CC(=CC6=C(C=C5)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O.[Na].[Na].[Na].[Na].[Na].[Na]

InChIKey: GKOOKWDOKJAVBD-UHFFFAOYSA-N

InChI: InChI=1S/C35H26N4O21S6.6Na/c40-33(38-25-7-9-27(63(49,50)51)23-13-21(61(43,44)45)15-29(31(23)25)65(55,56)57)17-3-1-5-19(11-17)36-35(42)37-20-6-2-4-18(12-20)34(41)39-26-8-10-28(64(52,53)54)24-14-22(62(46,47)48)16-30(32(24)26)66(58,59)60;;;;;;/h1-16H,(H,38,40)(H,39,41)(H2,36,37,42)(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60);;;;;;
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NYC-488,新型钙蛋白酶抑制剂
- ≥94%
CAS号 : 1448429-06-8 Compound CID : 71660816

分子式: C₁₉H₁₇FN₆O₅S 分子量: 460.4

IUPAC Name: (2S,3S)-3-[[(2S)-1-[[1-(4-fluorophenyl)triazol-4-yl]methylamino]-1-oxo-3-(1,3-thiazol-4-yl)propan-2-yl]carbamoyl]oxirane-2-carboxylic acid

SMILES: C1=CC(=CC=C1N2C=C(N=N2)CNC(=O)C(CC3=CSC=N3)NC(=O)C4C(O4)C(=O)O)F

InChIKey: IPWMYOJQVHCYRC-JYJNAYRXSA-N

InChI: InChI=1S/C19H17FN6O5S/c20-10-1-3-13(4-2-10)26-7-12(24-25-26)6-21-17(27)14(5-11-8-32-9-22-11)23-18(28)15-16(31-15)19(29)30/h1-4,7-9,14-16H,5-6H2,(H,21,27)(H,23,28)(H,29,30)/t14-,15-,16-/m0/s1
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奥芬达唑
- ≥98%(HPLC)(N)
CAS号 : 53716-50-0 Compound CID : 40854

分子式: C₁₅H₁₃N₃O₃S 分子量: 315.35

IUPAC Name: methyl N-[6-(benzenesulfinyl)-1H-benzimidazol-2-yl]carbamate

SMILES: COC(=O)NC1=NC2=C(N1)C=C(C=C2)S(=O)C3=CC=CC=C3

InChIKey: BEZZFPOZAYTVHN-UHFFFAOYSA-N

InChI: InChI=1S/C15H13N3O3S/c1-21-15(19)18-14-16-12-8-7-11(9-13(12)17-14)22(20)10-5-3-2-4-6-10/h2-9H,1H3,(H2,16,17,18,19)
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