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小分子和化合物库
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ALC-0315CAS号: 2036272-55-4分子式: C48H95NO5 分子量: 766.27IUPAC Name: 6-[6-(2-hexyldecanoyloxy)hexyl-(4-hydroxybutyl)amino]hexyl 2-hexyldecanoateSMILES: CCCCCCCCC(CCCCCC)C(=O)OCCCCCCN(CCCCCCOC(=O)C(CCCCCC)CCCCCCCC)CCCCOInChIKey: QGWBEETXHOVFQS-UHFFFAOYSA-NInChI: 1S/C48H95NO5/c1-5-9-13-17-19-27-37-45(35-25-15-11-7-3)47(51)53-43-33-23-21-29-39-49(41-31-32-42-50)40-30-22-24-34-44-54-48(52)46(36-26-16-12-8-4)38-28-20-18-14-10-6-2/h45-46,50H,5-44H2,1-4H3
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花生四烯酸(AA)分子式: C20H32O2 分子量: 304.47IUPAC Name: (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acidSMILES: CCCCCC=CCC=CCC=CCC=CCCCC(=O)OInChIKey: YZXBAPSDXZZRGB-DOFZRALJSA-NInChI: 1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-,16-15-
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米替福新CAS号: 58066-85-6分子式: C21H46NO4P 分子量: 407.57IUPAC Name: hexadecyl 2-(trimethylazaniumyl)ethyl phosphateSMILES: CCCCCCCCCCCCCCCCOP(=O)([O-])OCC[N+](C)(C)CInChIKey: PQLXHQMOHUQAKB-UHFFFAOYSA-NInChI: 1S/C21H46NO4P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-25-27(23,24)26-21-19-22(2,3)4/h5-21H2,1-4H3
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1-油酰基-2-羟基-sn-甘油-3-磷酸胆碱CAS号: 19420-56-5分子式: C26H52NO7P 分子量: 521.67IUPAC Name: [(2R)-2-hydroxy-3-[(Z)-octadec-9-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphateSMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OInChIKey: YAMUFBLWGFFICM-PTGWMXDISA-NInChI: 1S/C26H52NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h12-13,25,28H,5-11,14-24H2,1-4H3/b13-12-/t25-/m1/s1
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顺式-4,7,10,13,16,19-二十二碳六烯酸(DHA)CAS号: 6217-54-5分子式: C22H32O2 分子量: 328.49IUPAC Name: (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoic acidSMILES: CCC=CCC=CCC=CCC=CCC=CCC=CCCC(=O)OInChIKey: MBMBGCFOFBJSGT-KUBAVDMBSA-NInChI: 1S/C22H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h3-4,6-7,9-10,12-13,15-16,18-19H,2,5,8,11,14,17,20-21H2,1H3,(H,23,24)/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18-
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1,2-二棕榈酰-sn-甘油-3-磷酰胆碱（DPPC）分子式: C40H80NO8P 分子量: 734.039IUPAC Name: [(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphateSMILES: CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCInChIKey: KILNVBDSWZSGLL-KXQOOQHDSA-NInChI: 1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1
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1,2-二油酰基-sn-甘油-3-磷酸-L-丝氨酸(钠盐)（DOPS）CAS号: 90693-88-2 Compound CID : 23692652分子式: C42H77NO10PNa 分子量: 810.02IUPAC Name: sodium;[(2S)-2-amino-2-carboxyethyl] [(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] phosphateSMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)([O-])OCC(C(=O)O)N)OC(=O)CCCCCCCC=CCCCCCCCC.[Na+]InChIKey: KPHZNDUWYZIXFY-YORIBCANSA-MInChI: See more
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NADA （N-花生四烯酰多巴胺）CAS号: 199875-69-9 Compound CID : 5282105分子式: C28H41NO3 分子量: 439.63IUPAC Name: (5Z,8Z,11Z,14Z)-N-[2-(3,4-dihydroxyphenyl)ethyl]icosa-5,8,11,14-tetraenamideSMILES: CCCCCC=CCC=CCC=CCC=CCCCC(=O)NCCC1=CC(=C(C=C1)O)OInChIKey: MVVPIAAVGAWJNQ-DOFZRALJSA-NInChI: See more
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1,2-二辛酰基-sn-甘油CAS号: 60514-48-9 Compound CID : 148879分子式: C19H36O5 分子量: 344.49IUPAC Name: [(2S)-3-hydroxy-2-octanoyloxypropyl] octanoateSMILES: CCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCInChIKey: ZQBULZYTDGUSSK-KRWDZBQOSA-NInChI: 1S/C19H36O5/c1-3-5-7-9-11-13-18(21)23-16-17(15-20)24-19(22)14-12-10-8-6-4-2/h17,20H,3-16H2,1-2H3/t17-/m0/s1
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亚油酸分子式: C18H32O2 分子量: 280.45IUPAC Name: (9Z,12Z)-octadeca-9,12-dienoic acidSMILES: CCCCCC=CCC=CCCCCCCCC(=O)OInChIKey: OYHQOLUKZRVURQ-HZJYTTRNSA-NInChI: 1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9-
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