按“信号通路”分类 - 小分子和化合物库

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吡啶-2，4-二羧酸（PCA）
- ≥99%
CAS号: 499-80-9 EC号: 207-892-2

分子式: C₇H₅NO₄ 分子量: 167.12

IUPAC Name: pyridine-2,4-dicarboxylic acid

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

InChIKey: MJIVRKPEXXHNJT-UHFFFAOYSA-N

InChI: 1S/C7H5NO4/c9-6(10)4-1-2-8-5(3-4)7(11)12/h1-3H,(H,9,10)(H,11,12)
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钙离子载体 A23187
- ≥97%
CAS号: 52665-69-7

分子式: C₂₉H₃₇N₃O₆ 分子量: 523.62

IUPAC Name: 5-(methylamino)-2-[[(2S,3R,5R,6S,8R,9R)-3,5,9-trimethyl-2-[(2S)-1-oxo-1-(1H-pyrrol-2-yl)propan-2-yl]-1,7-dioxaspiro[5.5]undecan-8-yl]methyl]-1,3-benzoxazole-4-carboxylic acid

SMILES: CC1CCC2(C(CC(C(O2)C(C)C(=O)C3=CC=CN3)C)C)OC1CC4=NC5=C(O4)C=CC(=C5C(=O)O)NC

InChIKey: HIYAVKIYRIFSCZ-CYEMHPAKSA-N

InChI: 1S/C29H37N3O6/c1-15-10-11-29(17(3)13-16(2)27(38-29)18(4)26(33)20-7-6-12-31-20)37-22(15)14-23-32-25-21(36-23)9-8-19(30-5)24(25)28(34)35/h6-9,12,15-18,22,27,30-31H,10-11,13-14H2,1-5H3,(H,34,35)/t15-,16-See more
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FG-4592,HIF-α脯氨酰羟化酶抑制剂
- ≥98%
CAS号: 808118-40-3

分子式: C₁₉H₁₆N₂O₅ 分子量: 352.34

IUPAC Name: 2-[(4-hydroxy-1-methyl-7-phenoxyisoquinoline-3-carbonyl)amino]acetic acid

SMILES: CC1=C2C=C(C=CC2=C(C(=N1)C(=O)NCC(=O)O)O)OC3=CC=CC=C3

InChIKey: YOZBGTLTNGAVFU-UHFFFAOYSA-N

InChI: 1S/C19H16N2O5/c1-11-15-9-13(26-12-5-3-2-4-6-12)7-8-14(15)18(24)17(21-11)19(25)20-10-16(22)23/h2-9,24H,10H2,1H3,(H,20,25)(H,22,23)
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IOX2,脯氨酰羟化酶2（PHD2）抑制剂
- ≥98%
CAS号: 931398-72-0

分子式: C₁₉H₁₆N₂O₅ 分子量: 352.34

IUPAC Name: 2-[(1-benzyl-4-hydroxy-2-oxoquinoline-3-carbonyl)amino]acetic acid

SMILES: C1=CC=C(C=C1)CN2C3=CC=CC=C3C(=C(C2=O)C(=O)NCC(=O)O)O

InChIKey: CAOSCCRYLYQBES-UHFFFAOYSA-N

InChI: 1S/C19H16N2O5/c22-15(23)10-20-18(25)16-17(24)13-8-4-5-9-14(13)21(19(16)26)11-12-6-2-1-3-7-12/h1-9,24H,10-11H2,(H,20,25)(H,22,23)
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α-酮戊二酸
- ≥99%
CAS号: 328-50-7 EC号: 206-330-3

分子式: C₅H₆O₅ 分子量: 146.1

IUPAC Name: 2-oxopentanedioic acid

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

InChIKey: KPGXRSRHYNQIFN-UHFFFAOYSA-N

InChI: 1S/C5H6O5/c6-3(5(9)10)1-2-4(7)8/h1-2H2,(H,7,8)(H,9,10)
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α-酮戊二酸
- ≥98%
CAS号: 328-50-7 EC号: 206-330-3

分子式: C₅H₆O₅ 分子量: 146.1

IUPAC Name: 2-oxopentanedioic acid

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

InChIKey: KPGXRSRHYNQIFN-UHFFFAOYSA-N

InChI: 1S/C5H6O5/c6-3(5(9)10)1-2-4(7)8/h1-2H2,(H,7,8)(H,9,10)
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伐度司他
- ≥97%
CAS号: 1000025-07-9

分子式: C₁₄H₁₁ClN₂O₄ 分子量: 306.701

IUPAC Name: 2-[[5-(3-chlorophenyl)-3-hydroxypyridine-2-carbonyl]amino]acetic acid

SMILES: C1=CC(=CC(=C1)Cl)C2=CC(=C(N=C2)C(=O)NCC(=O)O)O

InChIKey: JGRXMPYUTJLTKT-UHFFFAOYSA-N

InChI: 1S/C14H11ClN2O4/c15-10-3-1-2-8(4-10)9-5-11(18)13(16-6-9)14(21)17-7-12(19)20/h1-6,18H,7H2,(H,17,21)(H,19,20)
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醋酸奥曲肽
- ≥99%
CAS号: 79517-01-4

分子式: C₅₁H₇₀N₁₀O₁₂S₂ 分子量: 1079.29

IUPAC Name: (4R,7S,10S,13R,16S,19R)-10-(4-aminobutyl)-19-[[(2R)-2-amino-3-phenylpropanoyl]amino]-16-benzyl-N-[(2R,3R)-1,3-dihydroxybutan-2-yl]-7-[(1R)-1-hydroxyethyl]-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxSee more

SMILES: CC(C1C(=O)NC(CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=CC=C4)NC(=O)C(CC5=CC=CC=C5)N)C(=O)NC(CO)C(C)O)O

InChIKey: DEQANNDTNATYII-OULOTJBUSA-N

InChI: 1S/C49H66N10O10S2/c1-28(61)39(25-60)56-48(68)41-27-71-70-26-40(57-43(63)34(51)21-30-13-5-3-6-14-30)47(67)54-37(22-31-15-7-4-8-16-31)45(65)55-38(23-32-24-52-35-18-10-9-17-33(32)35)46(66)53-36(19-11-12-See more
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BIM 23052,生长抑素（sst 5）受体5激动剂
CAS号: 133073-82-2

分子式: C₆₁H₇₅N₁₁O₁₀ 分子量: 1122.33

IUPAC Name: (2S)-6-amino-N-[(2S,3R)-1-[[(2S)-1-[[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-phenylprSee more

SMILES: CC(C(C(=O)N)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(C(C)O)NC(=O)C(CCCCN)NC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C(CC4=CC=CC=C4)NC(=O)C(CC5=CC=CC=C5)NC(=O)C(CC6=CC=CC=C6)N)O

InChIKey: HMTCBXPQKWFOMG-QWXJMLLVSA-N

InChI: 1S/C61H75N11O10/c1-37(73)52(54(64)75)71-60(81)50(34-42-25-13-6-14-26-42)70-61(82)53(38(2)74)72-56(77)47(29-17-18-30-62)66-59(80)51(35-43-36-65-46-28-16-15-27-44(43)46)69-58(79)49(33-41-23-11-5-12-24-4See more
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BIM 23056,生长抑素受体5（sst 5）拮抗剂
- ≥98%
CAS号: 150155-61-6 Compound CID : 16133799

分子式: C₇₁H₈₁N₁₁O₉ 分子量: 1232.49

IUPAC Name: (2S)-6-amino-N-[(2S)-1-[[(2S)-1-[[(2R)-1-amino-3-naphthalen-2-yl-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-phenylSee more

SMILES: CC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC2=CC3=CC=CC=C3C=C2)C(=O)N)NC(=O)C(CCCCN)NC(=O)C(CC4=CNC5=CC=CC=C54)NC(=O)C(CC6=CC=C(C=C6)O)NC(=O)C(CC7=CC=CC=C7)NC(=O)C(CC8=CC=CC=C8)N

InChIKey: VPTPBEUWKCLZGU-OOSWLFMASA-N

InChI: 1S/C71H81N11O9/c1-44(2)63(71(91)81-61(39-47-22-10-5-11-23-47)67(87)77-58(64(74)84)41-49-29-32-50-24-12-13-25-51(50)36-49)82-66(86)57(28-16-17-35-72)76-70(90)62(42-52-43-75-56-27-15-14-26-54(52)56)80-6See more
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兰瑞肽
- ≥95%
CAS号: 108736-35-2

分子式: C₅₄H₆₉N₁₁O₁₀S₂ 分子量: 1096.33

IUPAC Name: 10-(4-aminobutyl)-N-(1-amino-3-hydroxy-1-oxobutan-2-yl)-19-[(2-amino-3-naphthalen-2-ylpropanoyl)amino]-16-[(4-hydroxyphenyl)methyl]-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-7-propan-2-yl-1,2-ditSee more

SMILES: CC(C)C1C(=O)NC(CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=C(C=C4)O)NC(=O)C(CC5=CC6=CC=CC=C6C=C5)N)C(=O)NC(C(C)O)C(=O)N

InChIKey: PUDHBTGHUJUUFI-UHFFFAOYSA-N

InChI: 1S/C54H69N11O10S2/c1-29(2)45-54(75)63-44(53(74)65-46(30(3)66)47(57)68)28-77-76-27-43(62-48(69)38(56)23-32-15-18-33-10-4-5-11-34(33)22-32)52(73)60-41(24-31-16-19-36(67)20-17-31)50(71)61-42(25-35-26-58-See more
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L-817,818,SST5激动剂
- ≥99%(HPLC)
CAS号: 217480-27-8 Compound CID : 9937014

分子式: C₃₃H₃₆N₄O₃ 分子量: 536.67

IUPAC Name: [(2S)-2-aminopropyl] (2R)-6-amino-2-[[2-(2-naphthalen-2-yl-1H-benzo[g]indol-3-yl)acetyl]amino]hexanoate

SMILES: CC(COC(=O)C(CCCCN)NC(=O)CC1=C(NC2=C1C=CC3=CC=CC=C32)C4=CC5=CC=CC=C5C=C4)N

InChIKey: NFVRGDRCCNEGBS-KCWXNJEJSA-N

InChI: 1S/C33H36N4O3/c1-21(35)20-40-33(39)29(12-6-7-17-34)36-30(38)19-28-27-16-15-23-9-4-5-11-26(23)32(27)37-31(28)25-14-13-22-8-2-3-10-24(22)18-25/h2-5,8-11,13-16,18,21,29,37H,6-7,12,17,19-20,34-35H2,1H3,(HSee more
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