抗感染 - 按“信号通路”分类 - 小分子和化合物库

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DL-3-氨基丁酸

规格或纯度 :

≥97%

CAS号 : 541-48-0 Compound CID : 10932

分子式: C₄H₉NO₂ 分子量: 103.12

IUPAC Name: 3-aminobutanoic acid

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

InChIKey: OQEBBZSWEGYTPG-UHFFFAOYSA-N

InChI: InChI=1S/C4H9NO2/c1-3(5)2-4(6)7/h3H,2,5H2,1H3,(H,6,7)

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长川霉素

规格或纯度 :

≥97%

CAS号 : 104987-12-4 Compound CID : 5282071

分子式: C₄₃H₆₉NO₁₂ 分子量: 792.01

IUPAC Name: (1R,9S,12S,13R,14S,17R,18E,21S,23S,24R,25S,27R)-17-ethyl-1,14-dihydroxy-12-[(E)-1-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]prop-1-en-2-yl]-23,25-dimethoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone

SMILES: CCC1C=C(CC(CC(C2C(CC(C(O2)(C(=O)C(=O)N3CCCCC3C(=O)OC(C(C(CC1=O)O)C)C(=CC4CCC(C(C4)OC)O)C)O)C)OC)OC)C)C

InChIKey: ZDQSOHOQTUFQEM-NURRSENYSA-N

InChI: InChI=1S/C43H69NO12/c1-10-30-18-24(2)17-25(3)19-36(53-8)39-37(54-9)21-27(5)43(51,56-39)40(48)41(49)44-16-12-11-13-31(44)42(50)55-38(28(6)33(46)23-34(30)47)26(4)20-29-14-15-32(45)35(22-29)52-7/h18,20,25,27-33,35-39,45-46,51H,10-17,19,21-23H2,1-9H3/b24-18+,26-20+/t25-,27+,28+,29-,30+,31-,32+,33-,35+,36-,37-,38+,39+,43+/m0/s1

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蒽醌

规格或纯度 :

化学纯（CP）

≥97%

CAS号 : 84-65-1

分子式: C₁₄H₈O₂ 分子量: 208.21

IUPAC Name: anthracene-9,10-dione

SMILES: C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3C2=O

InChIKey: RZVHIXYEVGDQDX-UHFFFAOYSA-N

InChI: InChI=1S/C14H8O2/c15-13-9-5-1-2-6-10(9)14(16)12-8-4-3-7-11(12)13/h1-8H

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茴香霉素

规格或纯度 :

≥97%

CAS号 : 22862-76-6 Compound CID : 253602

分子式: C₁₄H₁₉NO₄ 分子量: 265.3

IUPAC Name: [(2R,3S,4S)-4-hydroxy-2-[(4-methoxyphenyl)methyl]pyrrolidin-3-yl] acetate

SMILES: CC(=O)OC1C(CNC1CC2=CC=C(C=C2)OC)O

InChIKey: YKJYKKNCCRKFSL-RDBSUJKOSA-N

InChI: InChI=1S/C14H19NO4/c1-9(16)19-14-12(15-8-13(14)17)7-10-3-5-11(18-2)6-4-10/h3-6,12-15,17H,7-8H2,1-2H3/t12-,13+,14+/m1/s1

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硫酸阿米卡星

规格或纯度 :

≥97%

CAS号 : 39831-55-5 Compound CID : 38351

分子式: C₂₂H₄₃N₅O₁₃·2H₂SO₄ 分子量: 781.76

IUPAC Name: (2S)-4-amino-N-[(1R,2S,3S,4R,5S)-5-amino-2-[(2S,3R,4S,5S,6R)-4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2R,3R,4S,5S,6R)-6-(aminomethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-3-hydroxycyclohexyl]-2-hydroxybutanamide;sulfuric acid

SMILES: C1C(C(C(C(C1NC(=O)C(CCN)O)OC2C(C(C(C(O2)CO)O)N)O)O)OC3C(C(C(C(O3)CN)O)O)O)N.OS(=O)(=O)O.OS(=O)(=O)O

InChIKey: FXKSEJFHKVNEFI-GCZBSULCSA-N

InChI: InChI=1S/C22H43N5O13.2H2O4S/c23-2-1-8(29)20(36)27-7-3-6(25)18(39-22-16(34)15(33)13(31)9(4-24)37-22)17(35)19(7)40-21-14(32)11(26)12(30)10(5-28)38-21;2*1-5(2,3)4/h6-19,21-22,28-35H,1-5,23-26H2,(H,27,36);2*(H2,1,2,3,4)/t6-,7+,8-,9+,10+,11-,12+,13+,14+,15-,16+,17-,18+,19-,21+,22+;;/m0../s1

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腺苷-5'-单磷酸一水合物

规格或纯度 :

≥97%
from yeast

CAS号 : 18422-05-4 Compound CID : 6419976

分子式: C₁₀H₁₄N₅O₇P·H₂O 分子量: 365.24

IUPAC Name: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate;hydrate

SMILES: O[C@H]1[C@@H](O)[C@H](N(C=N2)C3=C2C(N)=NC=N3)O[C@@H]1COP(O)(O)=O.O

InChIKey: ZOEFQKVADUBYKV-MCDZGGTQSA-N

InChI: InChI=1S/C10H14N5O7P.H2O/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20;/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20);1H2/t4-,6-,7-,10-;/m1./s1

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香紫苏内酯

规格或纯度 :

≥97%

CAS号 : 564-20-5 Compound CID : 929262

分子式: C₁₆H₂₆O₂ 分子量: 250.38

IUPAC Name: (3aR,5aS,9aS,9bR)-3a,6,6,9a-tetramethyl-1,4,5,5a,7,8,9,9b-octahydrobenzo[e][1]benzofuran-2-one

SMILES: CC1(CCCC2(C1CCC3(C2CC(=O)O3)C)C)C

InChIKey: IMKJGXCIJJXALX-SHUKQUCYSA-N

InChI: InChI=1S/C16H26O2/c1-14(2)7-5-8-15(3)11(14)6-9-16(4)12(15)10-13(17)18-16/h11-12H,5-10H2,1-4H3/t11-,12+,15-,16+/m0/s1

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棕榈酸甲酯

规格或纯度 :

≥97%

CAS号 : 112-39-0 Compound CID : 8181

分子式: C₁₇H₃₄O₂ 分子量: 270.45

IUPAC Name: methyl hexadecanoate

SMILES: CCCCCCCCCCCCCCCC(=O)OC

InChIKey: FLIACVVOZYBSBS-UHFFFAOYSA-N

InChI: InChI=1S/C17H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19-2/h3-16H2,1-2H3

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莫能霉素钠

规格或纯度 :

≥97%

CAS号 : 22373-78-0 Compound CID : 23667299

分子式: C₃₆H₆₁NaO₁₁ 分子量: 692.85

IUPAC Name: sodium;(2S,3R,4S)-4-[(2S,5R,7S,8R,9S)-2-[(2R,5S)-5-ethyl-5-[(2R,3S,5R)-5-[(2S,3S,5R,6R)-6-hydroxy-6-(hydroxymethyl)-3,5-dimethyloxan-2-yl]-3-methyloxolan-2-yl]oxolan-2-yl]-7-hydroxy-2,8-dimethyl-1,10-dioxaspiro[4.5]decan-9-yl]-3-methoxy-2-methylpentanoate

SMILES: CCC1(CCC(O1)C2(CCC3(O2)CC(C(C(O3)C(C)C(C(C)C(=O)[O-])OC)C)O)C)C4C(CC(O4)C5C(CC(C(O5)(CO)O)C)C)C.[Na+]

InChIKey: XOIQMTLWECTKJL-FBZUZRIGSA-M

InChI: InChI=1S/C36H62O11.Na/c1-10-34(31-20(3)16-26(43-31)28-19(2)15-21(4)36(41,18-37)46-28)12-11-27(44-34)33(8)13-14-35(47-33)17-25(38)22(5)30(45-35)23(6)29(42-9)24(7)32(39)40;/h19-31,37-38,41H,10-18H2,1-9H3,(H,39,40);/q;+1/p-1/t19-,20-,21+,22+,23-,24-,25-,26+,27+,28-,29+,30-,31+,33-,34-,35+,36-;/m0./s1

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麦芽四糖

规格或纯度 :

Moligand™

≥97%

CAS号 : 34612-38-9 Compound CID : 446495

分子式: C₂₄H₄₂O₂₁ 分子量: 666.58

IUPAC Name: (2R,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-6-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6S)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

SMILES: C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC3C(OC(C(C3O)O)OC4C(OC(C(C4O)O)O)CO)CO)CO)O)O)O)O

InChIKey: LUEWUZLMQUOBSB-ZLBHSGTGSA-N

InChI: InChI=1S/C24H42O21/c25-1-5-9(29)10(30)15(35)22(40-5)44-19-7(3-27)42-24(17(37)12(19)32)45-20-8(4-28)41-23(16(36)13(20)33)43-18-6(2-26)39-21(38)14(34)11(18)31/h5-38H,1-4H2/t5-,6-,7-,8-,9-,10+,11-,12-,13-,14-,15-,16-,17-,18-,19-,20-,21+,22-,23-,24-/m1/s1

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2-甲基蒽醌

规格或纯度 :

≥97%

CAS号 : 84-54-8 Compound CID : 6773

分子式: C₁₅H₁₀O₂ 分子量: 222.24

IUPAC Name: 2-methylanthracene-9,10-dione

SMILES: CC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O

InChIKey: NJWGQARXZDRHCD-UHFFFAOYSA-N

InChI: InChI=1S/C15H10O2/c1-9-6-7-12-13(8-9)15(17)11-5-3-2-4-10(11)14(12)16/h2-8H,1H3

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米托蒽醌二盐酸盐

规格或纯度 :

≥97%

CAS号 : 70476-82-3 Compound CID : 51082

分子式: C₂₂H₂₈N₄O₆·2HCl 分子量: 517.4

IUPAC Name: 1,4-dihydroxy-5,8-bis[2-(2-hydroxyethylamino)ethylamino]anthracene-9,10-dione;dihydrochloride

SMILES: C1=CC(=C2C(=C1NCCNCCO)C(=O)C3=C(C=CC(=C3C2=O)O)O)NCCNCCO.Cl.Cl

InChIKey: ZAHQPTJLOCWVPG-UHFFFAOYSA-N

InChI: InChI=1S/C22H28N4O6.2ClH/c27-11-9-23-5-7-25-13-1-2-14(26-8-6-24-10-12-28)18-17(13)21(31)19-15(29)3-4-16(30)20(19)22(18)32;;/h1-4,23-30H,5-12H2;2*1H

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