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吡美莫司CAS号: 137071-32-0分子式: C43H68ClNO11 分子量: 810.45IUPAC Name: See moreSMILES: 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)Cl)C)O)C)OC)OC)C)CInChIKey: KASDHRXLYQOAKZ-XDSKOBMDSA-NInChI: See more
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(R)-磷酸单-[2-氨基-2-(3-辛基-苯基氨基甲酰基)-乙基]酯CAS号: 449173-19-7 Compound CID : 11588811分子式: C17H29N2O5P 分子量: 372.396IUPAC Name: [(2R)-2-amino-3-(3-octylanilino)-3-oxopropyl] dihydrogen phosphateSMILES: CCCCCCCCC1=CC(=CC=C1)NC(=O)C(COP(=O)(O)O)NInChIKey: MRUSUGVVWGNKFE-MRXNPFEDSA-NInChI: 1S/C17H29N2O5P/c1-2-3-4-5-6-7-9-14-10-8-11-15(12-14)19-17(20)16(18)13-24-25(21,22)23/h8,10-12,16H,2-7,9,13,18H2,1H3,(H,19,20)(H2,21,22,23)/t16-/m1/s1
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雷帕霉素CAS号: 53123-88-9分子式: C51H79NO13 分子量: 914.19IUPAC Name: See moreSMILES: CC1CCC2CC(C(=CC=CC=CC(CC(C(=O)C(C(C(=CC(C(=O)CC(OC(=O)C3CCCCN3C(=O)C(=O)C1(O2)O)C(C)CC4CCC(C(C4)OC)O)C)C)O)OC)C)C)C)OCInChIKey: QFJCIRLUMZQUOT-HPLJOQBZSA-NInChI: See more
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他克莫斯(无水)(FK506)CAS号: 104987-11-3分子式: C44H69NO12 分子量: 804.02IUPAC Name: See moreSMILES: CC1CC(C2C(CC(C(O2)(C(=O)C(=O)N3CCCCC3C(=O)OC(C(C(CC(=O)C(C=C(C1)C)CC=C)O)C)C(=CC4CCC(C(C4)OC)O)C)O)C)OC)OCInChIKey: QJJXYPPXXYFBGM-LFZNUXCKSA-NInChI: See more
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他克莫斯(无水)(FK506)CAS号: 104987-11-3分子式: C44H69NO12 分子量: 804.02IUPAC Name: See moreSMILES: CC1CC(C2C(CC(C(O2)(C(=O)C(=O)N3CCCCC3C(=O)OC(C(C(CC(=O)C(C=C(C1)C)CC=C)O)C)C(=CC4CCC(C(C4)OC)O)C)O)C)OC)OCInChIKey: QJJXYPPXXYFBGM-LFZNUXCKSA-NInChI: See more
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D-赤型鞘氨醇-1-磷酸CAS号: 26993-30-6分子式: C18H38NO5P 分子量: 379.472IUPAC Name: [(E,2S,3R)-2-amino-3-hydroxyoctadec-4-enyl] dihydrogen phosphateSMILES: CCCCCCCCCCCCCC=CC(C(COP(=O)(O)O)N)OInChIKey: DUYSYHSSBDVJSM-KRWOKUGFSA-NInChI: 1S/C18H38NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)17(19)16-24-25(21,22)23/h14-15,17-18,20H,2-13,16,19H2,1H3,(H2,21,22,23)/b15-14+/t17-,18+/m0/s1
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Ponesimod,磷酸鞘氨醇受体激动剂CAS号: 854107-55-4 Compound CID : 11363176分子式: C23H25ClN2O4S 分子量: 460.974IUPAC Name: (5Z)-5-[[3-chloro-4-[(2R)-2,3-dihydroxypropoxy]phenyl]methylidene]-3-(2-methylphenyl)-2-propylimino-1,3-thiazolidin-4-oneSMILES: CCCN=C1N(C(=O)C(=CC2=CC(=C(C=C2)OCC(CO)O)Cl)S1)C3=CC=CC=C3CInChIKey: LPAUOXUZGSBGDU-ULCCENQXSA-NInChI: 1S/C23H25ClN2O4S/c1-3-10-25-23-26(19-7-5-4-6-15(19)2)22(29)21(31-23)12-16-8-9-20(18(24)11-16)30-14-17(28)13-27/h4-9,11-12,17,27-28H,3,10,13-14H2,1-2H3/b21-12-,25-23?/t17-/m1/s1
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放线菌酮CAS号: 66-81-9分子式: C15H23NO4 分子量: 281.35IUPAC Name: 4-[(2R)-2-[(1S,3S,5S)-3,5-dimethyl-2-oxocyclohexyl]-2-hydroxyethyl]piperidine-2,6-dioneSMILES: CC1CC(C(=O)C(C1)C(CC2CC(=O)NC(=O)C2)O)CInChIKey: YPHMISFOHDHNIV-FSZOTQKASA-NInChI: 1S/C15H23NO4/c1-8-3-9(2)15(20)11(4-8)12(17)5-10-6-13(18)16-14(19)7-10/h8-12,17H,3-7H2,1-2H3,(H,16,18,19)/t8-,9-,11-,12+/m0/s1
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雷帕霉素CAS号: 53123-88-9分子式: C51H79NO13 分子量: 914.19IUPAC Name: See moreSMILES: CC1CCC2CC(C(=CC=CC=CC(CC(C(=O)C(C(C(=CC(C(=O)CC(OC(=O)C3CCCCN3C(=O)C(=O)C1(O2)O)C(C)CC4CCC(C(C4)OC)O)C)C)O)OC)C)C)C)OCInChIKey: QFJCIRLUMZQUOT-HPLJOQBZSA-NInChI: See more
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芬戈莫德CAS号: 162359-55-9分子式: C19H33NO2 分子量: 307.47IUPAC Name: 2-amino-2-[2-(4-octylphenyl)ethyl]propane-1,3-diolSMILES: CCCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)NInChIKey: KKGQTZUTZRNORY-UHFFFAOYSA-NInChI: 1S/C19H33NO2/c1-2-3-4-5-6-7-8-17-9-11-18(12-10-17)13-14-19(20,15-21)16-22/h9-12,21-22H,2-8,13-16,20H2,1H3
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TY-52156,新型S1P3受体拮抗剂CAS号: 934369-14-9 Compound CID : 16046248分子式: C18H19Cl2N3O 分子量: 364.27IUPAC Name: N-(4-chloroanilino)-N'-(4-chlorophenyl)-3,3-dimethyl-2-oxobutanimidamideSMILES: CC(C)(C)C(=O)C(=NC1=CC=C(C=C1)Cl)NNC2=CC=C(C=C2)ClInChIKey: XONRRGIRSGNWFP-UHFFFAOYSA-NInChI: 1S/C18H19Cl2N3O/c1-18(2,3)16(24)17(21-14-8-4-12(19)5-9-14)23-22-15-10-6-13(20)7-11-15/h4-11,22H,1-3H3,(H,21,23)
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