小分子和化合物库
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戈米辛K3CAS号: 69363-14-0分子式: C23H30O6 分子量: 402.49IUPAC Name: (9S,10R)-4,5,14,15,16-pentamethoxy-9,10-dimethyltricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaen-3-olSMILES: CC1CC2=CC(=C(C(=C2C3=C(C(=C(C=C3CC1C)OC)OC)OC)O)OC)OCInChIKey: FYSHYFPJBONYCQ-QWHCGFSZSA-NInChI: 1S/C23H30O6/c1-12-8-14-10-16(25-3)21(27-5)20(24)18(14)19-15(9-13(12)2)11-17(26-4)22(28-6)23(19)29-7/h10-13,24H,8-9H2,1-7H3/t12-,13+/m0/s1
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(E)-1-苄氧基-2-甲氧基-4-(1-丙烯基)苯CAS号: 92666-21-2分子式: C17H18O2 分子量: 254.33IUPAC Name: 2-methoxy-1-phenylmethoxy-4-[(E)-prop-1-enyl]benzeneSMILES: CC=CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OCInChIKey: YKSSSKBJDZDZTD-XVNBXDOJSA-NInChI: 1S/C17H18O2/c1-3-7-14-10-11-16(17(12-14)18-2)19-13-15-8-5-4-6-9-15/h3-12H,13H2,1-2H3/b7-3+
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1-乙酰氧基-2-甲氧基-4-[(E)-1-丙烯基]苯CAS号: 5912-87-8分子式: C12H14O3 分子量: 206.24IUPAC Name: [2-methoxy-4-[(E)-prop-1-enyl]phenyl] acetateSMILES: CC=CC1=CC(=C(C=C1)OC(=O)C)OCInChIKey: IUSBVFZKQJGVEP-SNAWJCMRSA-NInChI: 1S/C12H14O3/c1-4-5-10-6-7-11(15-9(2)13)12(8-10)14-3/h4-8H,1-3H3/b5-4+
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L-丝氨酸-¹³C₃,¹⁵NCAS号: 202407-34-9 Compound CID : 71310240分子式: (¹³C)₃H₇(₁₅N)O₃ 分子量: 109.06SMILES: [13CH2]([C@@H]([13C](=O)O)[15NH2])O
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L-天冬氨酸-¹³C₄,¹⁵NCAS号: 202468-27-7分子式: HO213C13CH213CH(15NH2)13CO2H 分子量: 138.07IUPAC Name: (2S)-2-(15N)azanyl(1,2,3,4-13C4)butanedioic acidSMILES: C(C(C(=O)O)N)C(=O)OInChIKey: CKLJMWTZIZZHCS-NYTNKSBQSA-NInChI: 1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/t2-/m0/s1/i1+1,2+1,3+1,4+1,5+1
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八甘醇单十二烷基醚CAS号: 3055-98-9分子式: CH3(CH2)11(OCH2CH2)8OH 分子量: 538.75IUPAC Name: 2-[2-[2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanolSMILES: CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCCOInChIKey: YYELLDKEOUKVIQ-UHFFFAOYSA-NInChI: 1S/C28H58O9/c1-2-3-4-5-6-7-8-9-10-11-13-30-15-17-32-19-21-34-23-25-36-27-28-37-26-24-35-22-20-33-18-16-31-14-12-29/h29H,2-28H2,1H3
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花生四烯酸乙酯CAS号: 1808-26-0分子式: C22H36O2 分子量: 332.52IUPAC Name: ethyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoateSMILES: CCCCCC=CCC=CCC=CCC=CCCCC(=O)OCCInChIKey: SNXPWYFWAZVIAU-GKFVBPDJSA-NInChI: InChI=1S/C22H36O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24-4-2/h8-9,11-12,14-15,17-18H,3-7,10,13,16,19-21H2,1-2H3/b9-8-,12-11-,15-14-,18-17-
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