小分子和化合物库
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胃蛋白酶抑制剂CAS号: 26305-03-3分子式: C34H63N5O9 分子量: 685.89IUPAC Name: See moreSMILES: CC(C)CC(C(CC(=O)O)O)NC(=O)C(C)NC(=O)CC(C(CC(C)C)NC(=O)C(C(C)C)NC(=O)C(C(C)C)NC(=O)CC(C)C)OInChIKey: FAXGPCHRFPCXOO-LXTPJMTPSA-NInChI: See more
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甘草酸二钾水合物CAS号: 68797-35-3 Compound CID : 656852分子式: C42H60K2O16·xH2O 分子量: 899.12(as Anhydrous)IUPAC Name: See moreSMILES: CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)[O-])O)O)OC5C(C(C(C(O5)C(=O)[O-])O)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)C.[K+].[K+]InChIKey: BIVBRWYINDPWKA-VLQRKCJKSA-LInChI: See more
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香豆素-d4CAS号: 185056-83-1分子式: C9H2D4O2 分子量: 150.15IUPAC Name: 5,6,7,8-tetradeuteriochromen-2-oneSMILES: C1=CC=C2C(=C1)C=CC(=O)O2InChIKey: ZYGHJZDHTFUPRJ-RHQRLBAQSA-NInChI: 1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H/i1D,2D,3D,4D
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L-甲硫氨酸-¹³C₅,¹⁵NCAS号: 202468-47-1分子式: 13CH3S13CH213CH213CH(15NH2)13CO2H 分子量: 155.17SMILES: [13CH3]S[13CH2][13CH2][13C@H]([15NH2])[13C](O)=OInChIKey: FFEARJCKVFRZRR-XAFSXMPTSA-NInChI: 1S/C5H11NO2S/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1/i1+1,2+1,3+1,4+1,5+1,6+1
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柠檬酸-1,5-¹³C₂CAS号: 302912-06-7分子式: HOC(CO2H)(CH213CO2H)2 分子量: 194.11IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylic acidSMILES: C(C(=O)O)C(CC(=O)O)(C(=O)O)OInChIKey: KRKNYBCHXYNGOX-CQDYUVAPSA-NInChI: 1S/C6H8O7/c7-3(8)1-6(13,5(11)12)2-4(9)10/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/i3+1,4+1
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