按“信号通路”分类 - 小分子和化合物库 | 纯度: ≥96%(HPLC), ≥99 atom% 13C,≥99%, ≥80%

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亚麻酸乙酯
- ≥80%
- 天然
CAS号 : 1191-41-9 Compound CID : 5367460

分子式: C₂₀H₃₄O₂ 分子量: 306.48

IUPAC Name: ethyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate

SMILES: CCC=CCC=CCC=CCCCCCCCC(=O)OCC

InChIKey: JYYFMIOPGOFNPK-AGRJPVHOSA-N

InChI: InChI=1S/C20H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h5-6,8-9,11-12H,3-4,7,10,13-19H2,1-2H3/b6-5-,9-8-,12-11-
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花生酸
- ≥80%
CAS号 : 506-30-9 Compound CID : 10467

分子式: C₂₀H₄₀O₂ 分子量: 312.53

IUPAC Name: icosanoic acid

SMILES: CCCCCCCCCCCCCCCCCCCC(=O)O

InChIKey: VKOBVWXKNCXXDE-UHFFFAOYSA-N

InChI: InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)
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两性霉素B
- ≥80%
- 750 μg/mg
CAS号 : 1397-89-3 Compound CID : 5280965

分子式: C₄₇H₇₃NO₁₇ 分子量: 924.08

IUPAC Name: (1R,3S,5R,6R,9R,11R,15S,16R,17R,18S,19E,21E,23E,25E,27E,29E,31E,33R,35S,36R,37S)-33-[(2R,3S,4S,5S,6R)-4-amino-3,5-dihydroxy-6-methyloxan-2-yl]oxy-1,3,5,6,9,11,17,37-octahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxylic acid

SMILES: CC1C=CC=CC=CC=CC=CC=CC=CC(CC2C(C(CC(O2)(CC(CC(C(CCC(CC(CC(=O)OC(C(C1O)C)C)O)O)O)O)O)O)O)C(=O)O)OC3C(C(C(C(O3)C)O)N)O

InChIKey: APKFDSVGJQXUKY-INPOYWNPSA-N

InChI: InChI=1S/C47H73NO17/c1-27-17-15-13-11-9-7-5-6-8-10-12-14-16-18-34(64-46-44(58)41(48)43(57)30(4)63-46)24-38-40(45(59)60)37(54)26-47(61,65-38)25-33(51)22-36(53)35(52)20-19-31(49)21-32(50)23-39(55)62-29(3)28(2)42(27)56/h5-18,27-38,40-44,46,49-54,56-58,61H,19-26,48H2,1-4H3,(H,59,60)/b6-5+,9-7+,10-8+,13-11+,14-12+,17-15+,18-16+/t27-,28-,29-,30+,31+,32+,33-,34-,35+,36+,37-,38-,40+,41-,42+,43+,44-,46-,47+/m0/s1
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美伐他汀
- ≥96%(HPLC)
CAS号 : 73573-88-3 Compound CID : 64715

分子式: C₂₃H₃₄O₅ 分子量: 390.51

IUPAC Name: [(1S,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-7-methyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] (2S)-2-methylbutanoate

SMILES: CCC(C)C(=O)OC1CCC=C2C1C(C(C=C2)C)CCC3CC(CC(=O)O3)O

InChIKey: AJLFOPYRIVGYMJ-INTXDZFKSA-N

InChI: InChI=1S/C23H34O5/c1-4-14(2)23(26)28-20-7-5-6-16-9-8-15(3)19(22(16)20)11-10-18-12-17(24)13-21(25)27-18/h6,8-9,14-15,17-20,22,24H,4-5,7,10-13H2,1-3H3/t14-,15-,17+,18+,19-,20-,22-/m0/s1
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代森联
- ≥80%
CAS号 : 9006-42-2 Compound CID : 5284484

分子式: (C₁₆H₃₃N₁₁S₁₆Zn₃)_x 分子量: (1088.6)x

IUPAC Name: zinc;N-[2-(sulfidocarbothioylamino)ethyl]carbamodithioate

SMILES: C(CNC(=S)[S-])NC(=S)[S-].[Zn+2]

InChIKey: AMHNZOICSMBGDH-UHFFFAOYSA-L

InChI: InChI=1S/C4H8N2S4.Zn/c7-3(8)5-1-2-6-4(9)10;/h1-2H2,(H2,5,7,8)(H2,6,9,10);/q;+2/p-2
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辛可宁盐酸盐水合物
- ≥80%
CAS号 : 5949-11-1

分子式: C₁₉H₂₂N₂O·HCl·xH₂O 分子量: 330.85

IUPAC Name: (S)-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol;hydrochloride

SMILES: C=CC1CN2CCC1CC2C(C3=CC=NC4=CC=CC=C34)O.Cl

InChIKey: IMUHWLVEEVGMBC-BKUXTCEESA-N

InChI: InChI=1S/C19H22N2O.ClH/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17;/h2-7,9,13-14,18-19,22H,1,8,10-12H2;1H/t13-,14-,18+,19-;/m0./s1
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β-胡萝卜素
- ≥96%(HPLC)
CAS号 : 7235-40-7 Compound CID : 5280489

分子式: C₄₀H₅₆ 分子量: 536.87

IUPAC Name: 1,3,3-trimethyl-2-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohexene

SMILES: CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2=C(CCCC2(C)C)C)C)C

InChIKey: OENHQHLEOONYIE-JLTXGRSLSA-N

InChI: InChI=1S/C40H56/c1-31(19-13-21-33(3)25-27-37-35(5)23-15-29-39(37,7)8)17-11-12-18-32(2)20-14-22-34(4)26-28-38-36(6)24-16-30-40(38,9)10/h11-14,17-22,25-28H,15-16,23-24,29-30H2,1-10H3/b12-11+,19-13+,20-14+,27-25+,28-26+,31-17+,32-18+,33-21+,34-22+
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大黄素
- ≥96%(HPLC)
CAS号 : 518-82-1 Compound CID : 3220

分子式: C₁₅H₁₀O₅ 分子量: 270.24

IUPAC Name: 1,3,8-trihydroxy-6-methylanthracene-9,10-dione

SMILES: CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)O

InChIKey: RHMXXJGYXNZAPX-UHFFFAOYSA-N

InChI: InChI=1S/C15H10O5/c1-6-2-8-12(10(17)3-6)15(20)13-9(14(8)19)4-7(16)5-11(13)18/h2-5,16-18H,1H3
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芥酸
- ≥80%
CAS号 : 112-86-7 Compound CID : 5281116

分子式: C₂₂H₄₂O₂ 分子量: 338.57

IUPAC Name: (Z)-docos-13-enoic acid

SMILES: CCCCCCCCC=CCCCCCCCCCCCC(=O)O

InChIKey: DPUOLQHDNGRHBS-KTKRTIGZSA-N

InChI: InChI=1S/C22H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h9-10H,2-8,11-21H2,1H3,(H,23,24)/b10-9-
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三硬脂酸甘油酯
- ≥80%
CAS号 : 555-43-1 Compound CID : 11146

分子式: C₅₇H₁₁₀O₆ 分子量: 891.49

IUPAC Name: 2,3-di(octadecanoyloxy)propyl octadecanoate

SMILES: CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC

InChIKey: DCXXMTOCNZCJGO-UHFFFAOYSA-N

InChI: InChI=1S/C57H110O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h54H,4-53H2,1-3H3
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羟乙基磺酸
- ≥80%
CAS号 : 107-36-8 Compound CID : 7866

分子式: C₂H₆O₄S 分子量: 126.1

IUPAC Name: 2-hydroxyethanesulfonic acid

SMILES: C(CS(=O)(=O)O)O

InChIKey: SUMDYPCJJOFFON-UHFFFAOYSA-N

InChI: InChI=1S/C2H6O4S/c3-1-2-7(4,5)6/h3H,1-2H2,(H,4,5,6)
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海柯皂苷元
- ≥80%
CAS号 : 467-55-0 Compound CID : 91453

分子式: C₂₇H₄₂O₄ 分子量: 430.63

IUPAC Name: (1R,2S,4S,5'R,6R,7S,8R,9S,12S,13S,16S,18S)-16-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-10-one

SMILES: CC1CCC2(C(C3C(O2)CC4C3(C(=O)CC5C4CCC6C5(CCC(C6)O)C)C)C)OC1

InChIKey: QOLRLLFJMZLYQJ-LOBDNJQFSA-N

InChI: InChI=1S/C27H42O4/c1-15-7-10-27(30-14-15)16(2)24-22(31-27)12-21-19-6-5-17-11-18(28)8-9-25(17,3)20(19)13-23(29)26(21,24)4/h15-22,24,28H,5-14H2,1-4H3/t15-,16+,17+,18+,19-,20+,21+,22+,24+,25+,26-,27-/m1/s1
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