PI3K
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CAY10505,PI3Kγ抑制剂CAS号 : 1218777-13-9 Compound CID : 1204893分子式: C14H8FNO3S 分子量: 289.28IUPAC Name: (5E)-5-[[5-(4-fluorophenyl)furan-2-yl]methylidene]-1,3-thiazolidine-2,4-dioneSMILES: C1=CC(=CC=C1C2=CC=C(O2)C=C3C(=O)NC(=O)S3)FInChIKey: UFBTYTGRUBUUIL-KPKJPENVSA-NInChI: InChI=1S/C14H8FNO3S/c15-9-3-1-8(2-4-9)11-6-5-10(19-11)7-12-13(17)16-14(18)20-12/h1-7H,(H,16,17,18)/b12-7+
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1-脱氧野尻霉素CAS号 : 19130-96-2分子式: C6H13NO4 分子量: 163.17IUPAC Name: (2R,3R,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-triolSMILES: C1C(C(C(C(N1)CO)O)O)OInChIKey: LXBIFEVIBLOUGU-JGWLITMVSA-NInChI: InChI=1S/C6H13NO4/c8-2-3-5(10)6(11)4(9)1-7-3/h3-11H,1-2H2/t3-,4+,5-,6-/m1/s1
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二氢辣椒碱CAS号 : 19408-84-5 Compound CID : 107982分子式: C18H29NO3 分子量: 307.43IUPAC Name: N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methylnonanamideSMILES: CC(C)CCCCCCC(=O)NCC1=CC(=C(C=C1)O)OCInChIKey: XJQPQKLURWNAAH-UHFFFAOYSA-NInChI: InChI=1S/C18H29NO3/c1-14(2)8-6-4-5-7-9-18(21)19-13-15-10-11-16(20)17(12-15)22-3/h10-12,14,20H,4-9,13H2,1-3H3,(H,19,21)
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二氢辣椒碱CAS号 : 19408-84-5 Compound CID : 107982分子式: C18H29NO3 分子量: 307.43IUPAC Name: N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methylnonanamideSMILES: CC(C)CCCCCCC(=O)NCC1=CC(=C(C=C1)O)OCInChIKey: XJQPQKLURWNAAH-UHFFFAOYSA-NInChI: InChI=1S/C18H29NO3/c1-14(2)8-6-4-5-7-9-18(21)19-13-15-10-11-16(20)17(12-15)22-3/h10-12,14,20H,4-9,13H2,1-3H3,(H,19,21)
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1,2-二油酰基-sn-甘油-3-磷酸-(1'-肌醇-3',4'-二磷酸酯)(铵盐)CAS号 : 799268-54-5 Compound CID : 145710213分子式: C45H94N3O19P3 分子量: 1074.158IUPAC Name: azane;[(2R)-3-[hydroxy-[(1S,2R,3R,4S,5S,6S)-2,3,6-trihydroxy-4,5-diphosphonooxycyclohexyl]oxyphosphoryl]oxy-2-[(Z)-octadec-9-enoyl]oxypropyl] (Z)-octadec-9-enoateSMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(O)OC1C(C(C(C(C1O)OP(=O)(O)O)OP(=O)(O)O)O)O)OC(=O)CCCCCCCC=CCCCCCCCC.NInChIKey: FWDOQVLMXPDBBT-YLGSFUNKSA-NInChI: InChI=1S/C45H85O19P3.H3N/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(46)59-35-37(61-39(47)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)36-60-67(57,58)64-43-40(48)41(49)44(62-65(51,52)53)45(42(43)50)63-66(54,55)56;/h17-20,37,40-45,48-50H,3-16,21-36H2,1-2H3,(H,57,58)(H2,51,52,53)(H2,54,55,56);1H3/b19-17-,20-18-;/t37-,40-,41-,42+,43+,44+,45+;/m1./s1
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芥酸分子式: C22H42O2 分子量: 338.57IUPAC Name: (Z)-docos-13-enoic acidSMILES: CCCCCCCCC=CCCCCCCCCCCCC(=O)OInChIKey: DPUOLQHDNGRHBS-KTKRTIGZSA-NInChI: 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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芥酸分子式: C22H42O2 分子量: 338.57IUPAC Name: (Z)-docos-13-enoic acidSMILES: CCCCCCCCC=CCCCCCCCCCCCC(=O)OInChIKey: DPUOLQHDNGRHBS-KTKRTIGZSA-NInChI: 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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GSK2636771CAS号 : 1372540-25-4 Compound CID : 56949517分子式: C22H22F3N3O3 分子量: 433.42IUPAC Name: 2-methyl-1-[[2-methyl-3-(trifluoromethyl)phenyl]methyl]-6-morpholin-4-ylbenzimidazole-4-carboxylic acidSMILES: CC1=C(C=CC=C1C(F)(F)F)CN2C(=NC3=C(C=C(C=C32)N4CCOCC4)C(=O)O)CInChIKey: XTKLTGBKIDQGQL-UHFFFAOYSA-NInChI: InChI=1S/C22H22F3N3O3/c1-13-15(4-3-5-18(13)22(23,24)25)12-28-14(2)26-20-17(21(29)30)10-16(11-19(20)28)27-6-8-31-9-7-27/h3-5,10-11H,6-9,12H2,1-2H3,(H,29,30)
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GSK1059615,PI 3-激酶抑制剂CAS号 : 958852-01-2 Compound CID : 23582824分子式: C18H11N3O2S 分子量: 333.36IUPAC Name: (5Z)-5-[(4-pyridin-4-ylquinolin-6-yl)methylidene]-1,3-thiazolidine-2,4-dioneSMILES: C1=CC2=NC=CC(=C2C=C1C=C3C(=O)NC(=O)S3)C4=CC=NC=C4InChIKey: QDITZBLZQQZVEE-YBEGLDIGSA-NInChI: InChI=1S/C18H11N3O2S/c22-17-16(24-18(23)21-17)10-11-1-2-15-14(9-11)13(5-8-20-15)12-3-6-19-7-4-12/h1-10H,(H,21,22,23)/b16-10-
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GDC-0980 (RG7422)CAS号 : 1032754-93-0 Compound CID : 25254071分子式: C23H30N8O3S 分子量: 498.61IUPAC Name: (2S)-1-[4-[[2-(2-aminopyrimidin-5-yl)-7-methyl-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]methyl]piperazin-1-yl]-2-hydroxypropan-1-oneSMILES: CC1=C(SC2=C1N=C(N=C2N3CCOCC3)C4=CN=C(N=C4)N)CN5CCN(CC5)C(=O)C(C)OInChIKey: YOVVNQKCSKSHKT-HNNXBMFYSA-NInChI: InChI=1S/C23H30N8O3S/c1-14-17(13-29-3-5-31(6-4-29)22(33)15(2)32)35-19-18(14)27-20(16-11-25-23(24)26-12-16)28-21(19)30-7-9-34-10-8-30/h11-12,15,32H,3-10,13H2,1-2H3,(H2,24,25,26)/t15-/m0/s1