按“信号通路”分类 - 小分子和化合物库 | 纯度: ≥98%(HPLC)(T), ≥99 atom% 15N,≥99 atom% 13C,≥95%, ≥93%

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2,4-二氯-5-磺酰胺基苯甲酸
- ≥98%(HPLC)(T)
CAS号 : 2736-23-4 Compound CID : 17655

分子式: C₇H₅Cl₂NO₄S 分子量: 270.09

IUPAC Name: 2,4-dichloro-5-sulfamoylbenzoic acid

SMILES: C1=C(C(=CC(=C1S(=O)(=O)N)Cl)Cl)C(=O)O

InChIKey: ZSHHRBYVHTVRFK-UHFFFAOYSA-N

InChI: InChI=1S/C7H5Cl2NO4S/c8-4-2-5(9)6(15(10,13)14)1-3(4)7(11)12/h1-2H,(H,11,12)(H2,10,13,14)
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3-羟基-3-甲基戊二酸
- ≥93%
CAS号 : 503-49-1 Compound CID : 1662

分子式: C₆H₁₀O₅ 分子量: 162.14

IUPAC Name: 3-hydroxy-3-methylpentanedioic acid

SMILES: CC(CC(=O)O)(CC(=O)O)O

InChIKey: NPOAOTPXWNWTSH-UHFFFAOYSA-N

InChI: InChI=1S/C6H10O5/c1-6(11,2-4(7)8)3-5(9)10/h11H,2-3H2,1H3,(H,7,8)(H,9,10)
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DL-异柠檬酸三钠盐水合物
- ≥93%
CAS号 : 1637-73-6 Compound CID : 168942

分子式: C₆H₅O₇Na₃·xH₂O 分子量: 258.07 (anhydrous basis)

IUPAC Name: trisodium;1-hydroxypropane-1,2,3-tricarboxylate

SMILES: C(C(C(C(=O)[O-])O)C(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+]

InChIKey: HWMVXEKEEAIYGB-UHFFFAOYSA-K

InChI: InChI=1S/C6H8O7.3Na/c7-3(8)1-2(5(10)11)4(9)6(12)13;;;/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13);;;/q;3*+1/p-3
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阿利马嗪酒石酸盐
- ≥98%(HPLC)(T)
CAS号 : 4330-99-8 Compound CID : 441236

分子式: C₃₆H₄₄N₄S₂·C₄H₆O₆ 分子量: 746.98

IUPAC Name: (2R,3R)-2,3-dihydroxybutanedioic acid;N,N,2-trimethyl-3-phenothiazin-10-ylpropan-1-amine

SMILES: CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)CN(C)C.CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)CN(C)C.C(C(C(=O)O)O)(C(=O)O)O

InChIKey: AJZJIYUOOJLBAU-CEAXSRTFSA-N

InChI: InChI=1S/2C18H22N2S.C4H6O6/c2*1-14(12-19(2)3)13-20-15-8-4-6-10-17(15)21-18-11-7-5-9-16(18)20;5-1(3(7)8)2(6)4(9)10/h2*4-11,14H,12-13H2,1-3H3;1-2,5-6H,(H,7,8)(H,9,10)/t;;1-,2-/m..1/s1
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胆固醇壬酸酯
- ≥93%
CAS号 : 1182-66-7 Compound CID : 2723614

分子式: C₃₆H₆₂O₂ 分子量: 526.89

IUPAC Name: [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] nonanoate

SMILES: CCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C

InChIKey: WCLNGBQPTVENHV-MKQVXYPISA-N

InChI: InChI=1S/C36H62O2/c1-7-8-9-10-11-12-16-34(37)38-29-21-23-35(5)28(25-29)17-18-30-32-20-19-31(27(4)15-13-14-26(2)3)36(32,6)24-22-33(30)35/h17,26-27,29-33H,7-16,18-25H2,1-6H3/t27-,29+,30+,31-,32+,33+,35+,36-/m1/s1
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1,4-屈醌
- ≥93%
CAS号 : 100900-16-1

分子式: C₁₈H₁₀O₂ 分子量: 258.28

IUPAC Name: chrysene-1,4-dione

SMILES: C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C(=O)C=CC4=O

InChIKey: UORKIKBNUWJNJF-UHFFFAOYSA-N

InChI: InChI=1S/C18H10O2/c19-16-9-10-17(20)18-14-6-5-11-3-1-2-4-12(11)13(14)7-8-15(16)18/h1-10H
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1,1'-二庚基-4,4'-二吡啶鎓二溴化物 [用于电致变色材料]
- ≥98%(HPLC)(T)
CAS号 : 6159-05-3

分子式: C₂₄H₃₈Br₂N₂ 分子量: 514.39

IUPAC Name: 1-heptyl-4-(1-heptylpyridin-1-ium-4-yl)pyridin-1-ium;dibromide

SMILES: CCCCCCC[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)CCCCCCC.[Br-].[Br-]

InChIKey: VRXAJMCFEOESJO-UHFFFAOYSA-L

InChI: InChI=1S/C24H38N2.2BrH/c1-3-5-7-9-11-17-25-19-13-23(14-20-25)24-15-21-26(22-16-24)18-12-10-8-6-4-2;;/h13-16,19-22H,3-12,17-18H2,1-2H3;2*1H/q+2;;/p-2
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2'-脱氧腺苷(无水)
- ≥98%(HPLC)(T)
CAS号 : 958-09-8 Compound CID : 13730

分子式: C₁₀H₁₃N₅O₃ 分子量: 251.25

IUPAC Name: (2R,3S,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol

SMILES: C1C(C(OC1N2C=NC3=C(N=CN=C32)N)CO)O

InChIKey: OLXZPDWKRNYJJZ-RRKCRQDMSA-N

InChI: InChI=1S/C10H13N5O3/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(17)6(2-16)18-7/h3-7,16-17H,1-2H2,(H2,11,12,13)/t5-,6+,7+/m0/s1
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脱羧氯雷他定
- ≥98%(HPLC)(T)
CAS号 : 100643-71-8 Compound CID : 124087

分子式: C₁₉H₁₉ClN₂ 分子量: 310.83

IUPAC Name: 13-chloro-2-piperidin-4-ylidene-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaene

SMILES: C1CC2=C(C=CC(=C2)Cl)C(=C3CCNCC3)C4=C1C=CC=N4

InChIKey: JAUOIFJMECXRGI-UHFFFAOYSA-N

InChI: InChI=1S/C19H19ClN2/c20-16-5-6-17-15(12-16)4-3-14-2-1-9-22-19(14)18(17)13-7-10-21-11-8-13/h1-2,5-6,9,12,21H,3-4,7-8,10-11H2
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4-羟基间苯二甲酸
- ≥98%(HPLC)(T)
CAS号 : 636-46-4 Compound CID : 12490

分子式: C₈H₆O₅ 分子量: 182.13

IUPAC Name: 4-hydroxybenzene-1,3-dicarboxylic acid

SMILES: C1=CC(=C(C=C1C(=O)O)C(=O)O)O

InChIKey: BCEQKAQCUWUNML-UHFFFAOYSA-N

InChI: InChI=1S/C8H6O5/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3,9H,(H,10,11)(H,12,13)
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3-羟基黄酮
- ≥98%(HPLC)(T)
CAS号 : 577-85-5 Compound CID : 11349

分子式: C₁₅H₁₀O₃ 分子量: 238.24

IUPAC Name: 3-hydroxy-2-phenylchromen-4-one

SMILES: C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)O

InChIKey: HVQAJTFOCKOKIN-UHFFFAOYSA-N

InChI: InChI=1S/C15H10O3/c16-13-11-8-4-5-9-12(11)18-15(14(13)17)10-6-2-1-3-7-10/h1-9,17H
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咪多卡二丙酸盐
- ≥98%(HPLC)(T)
CAS号 : 55750-06-6 Compound CID : 9983292

分子式: C₁₉H₂₀N₆O·2C₃H₆O₂ 分子量: 496.57

IUPAC Name: 1,3-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]urea;propanoic acid

SMILES: CCC(=O)O.CCC(=O)O.C1CN=C(N1)C2=CC(=CC=C2)NC(=O)NC3=CC=CC(=C3)C4=NCCN4

InChIKey: AFGQXWSHYUHHNV-UHFFFAOYSA-N

InChI: InChI=1S/C19H20N6O.2C3H6O2/c26-19(24-15-5-1-3-13(11-15)17-20-7-8-21-17)25-16-6-2-4-14(12-16)18-22-9-10-23-18;2*1-2-3(4)5/h1-6,11-12H,7-10H2,(H,20,21)(H,22,23)(H2,24,25,26);2*2H2,1H3,(H,4,5)
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