小分子和化合物库
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MC 1046CAS号: 126860-83-1 Compound CID : 9547342分子式: C27H38O3 分子量: 410.59IUPAC Name: (E,4R)-4-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(3S,5R)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-1-cyclopropylpent-2-en-1-oneSMILES: CC(C=CC(=O)C1CC1)C2CCC3C2(CCCC3=CC=C4CC(CC(C4=C)O)O)CInChIKey: KKDBQSPKXAUHPH-NRCQPIEOSA-NInChI: See more
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咪鲜安CAS号: 67747-09-5 EC号: 266-994-5分子式: C15H16Cl3N3O2 分子量: 376.67IUPAC Name: N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]imidazole-1-carboxamideSMILES: CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)N2C=CN=C2InChIKey: TVLSRXXIMLFWEO-UHFFFAOYSA-NInChI: 1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3
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DL-丙氨酸-¹⁵NCAS号: 71261-64-8分子式: CH3CH(15NH2)CO2H 分子量: 90.09IUPAC Name: 2-(15N)azanylpropanoic acidSMILES: CC(C(=O)O)NInChIKey: QNAYBMKLOCPYGJ-AZXPZELESA-NInChI: 1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/i4+1
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L-甲硫氨酸-(甲基-¹³C,d₃)CAS号: 73488-65-0分子式: 13CD3SCH2CH2CH(NH2)CO2H 分子量: 153.22IUPAC Name: (2S)-2-amino-4-(trideuterio(113C)methylsulfanyl)butanoic acidSMILES: [2H][13C]([2H])([2H])SCC[C@H](N)C(O)=OInChIKey: FFEARJCKVFRZRR-ZIHWZSJBSA-NInChI: 1S/C5H11NO2S/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1/i1+1D3
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L-谷氨酰胺-(胺-¹⁵N)CAS号: 80143-57-3分子式: H2NCO(CH2)2CH(15NH2)CO2H 分子量: 147.14IUPAC Name: (2S)-5-amino-2-(15N)azanyl-5-oxopentanoic acidSMILES: C(CC(=O)N)C(C(=O)O)NInChIKey: ZDXPYRJPNDTMRX-OGWWSMAPSA-NInChI: 1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1/i6+1
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吡啶-¹⁵NCAS号: 34322-45-7分子式: C5H5(15N) 分子量: 80.09IUPAC Name: (115N)pyridineSMILES: C1=CC=NC=C1InChIKey: JUJWROOIHBZHMG-PTQBSOBMSA-NInChI: 1S/C5H5N/c1-2-4-6-5-3-1/h1-5H/i6+1
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苯甲酰胺-¹⁵NCAS号: 31656-62-9分子式: C7H7¹⁵NO 分子量: 122.13IUPAC Name: (15N)benzamideSMILES: C1=CC=C(C=C1)C(=O)NInChIKey: KXDAEFPNCMNJSK-VJJZLTLGSA-NInChI: 1S/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9)/i8+1
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