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小分子和化合物库
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Nε，Nε，Nε-三甲基赖氨酸 盐酸盐CAS号: 55528-53-5分子式: C9H20N2O2・HCl 分子量: 224.73IUPAC Name: [(5S)-5-amino-5-carboxypentyl]-trimethylazanium;chlorideSMILES: C[N+](C)(C)CCCCC(C(=O)O)N.[Cl-]InChIKey: ZKIJKCHCMFGMCM-QRPNPIFTSA-NInChI: 1S/C9H20N2O2.ClH/c1-11(2,3)7-5-4-6-8(10)9(12)13;/h8H,4-7,10H2,1-3H3;1H/t8-;/m0./s1
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1,2-二油酰基-sn-丙三基-3-磷脂酰乙醇胺（DOPE）CAS号: 4004-05-1分子式: C41H78NO8P 分子量: 744.05IUPAC Name: [(2R)-3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-[(Z)-octadec-9-enoyl]oxypropyl] (Z)-octadec-9-enoateSMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(O)OCCN)OC(=O)CCCCCCCC=CCCCCCCCCInChIKey: MWRBNPKJOOWZPW-NYVOMTAGSA-NInChI: See more
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1-油基-2-乙酰基-sn-甘油CAS号: 86390-77-4分子式: C23H42O5 分子量: 398.57IUPAC Name: [(2S)-2-acetyloxy-3-hydroxypropyl] (Z)-octadec-9-enoateSMILES: CCCCCCCC\C=C/CCCCCCCC(=O)OC[C@H](CO)OC(C)=OInChIKey: PWTCCMJTPHCGMS-YRBAHSOBSA-NInChI: 1S/C23H42O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(26)27-20-22(19-24)28-21(2)25/h10-11,22,24H,3-9,12-20H2,1-2H3/b11-10-/t22-/m0/s1
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雌酮-2,4,16,16-d₄ 3-硫酸钠盐CAS号: 285979-80-8分子式: C18H22O5S 分子量: 354.5IUPAC Name: [(8R,9S,13S,14S)-2,4,16,16-tetradeuterio-13-methyl-17-oxo-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-yl] hydrogen sulfateSMILES: CC12CCC3C(C1CCC2=O)CCC4=C3C=CC(=C4)OS(=O)(=O)OInChIKey: JKKFKPJIXZFSSB-QSPUTOQOSA-NInChI: 1S/C18H22O5S/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19/h3,5,10,14-16H,2,4,6-9H2,1H3,(H,20,21,22)/t14-,15-,16+,18+/m1/s1/i3D,7D2,10D
