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小分子和化合物库
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盐酸头孢甲肟CAS号: 75738-58-8 Compound CID : 11954009分子式: C32H34N18O10S6·HCl 分子量: 1059.58IUPAC Name: (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;hydrochlorideSMILES: CN1C(=NN=N1)SCC2=C(N3C(C(C3=O)NC(=O)C(=NOC)C4=CSC(=N4)N)SC2)C(=O)O.CN1C(=NN=N1)SCC2=C(N3C(C(C3=O)NC(=O)C(=NOC)C4=CSC(=N4)N)SC2)C(=O)O.ClInChIKey: MPTNDTIREFCQLK-UNVJPQNDSA-NInChI: See more
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碳酸镱(III)水合物CAS号: 342385-48-2分子式: Yb2(CO3)3·xH2OIUPAC Name: ytterbium(3+);tricarbonate;hydrateSMILES: C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].O.[Yb+3].[Yb+3]InChIKey: ODWSGMKOTKPSQE-UHFFFAOYSA-HInChI: 1S/3CH2O3.H2O.2Yb/c3*2-1(3)4;;;/h3*(H2,2,3,4);1H2;;/q;;;;2*+3/p-6
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71 22-二氟-2-（4-甲基吡啶-2-基）乙酸CAS号: 1781036-04-1分子式: C8H7F2NO2 分子量: 187.15IUPAC Name: 2,2-difluoro-2-(4-methylpyridin-2-yl)acetic acidSMILES: CC1=CC(=NC=C1)C(C(=O)O)(F)FInChIKey: LCGRGGRRGPLBPI-UHFFFAOYSA-NInChI: 1S/C8H7F2NO2/c1-5-2-3-11-6(4-5)8(9,10)7(12)13/h2-4H,1H3,(H,12,13)
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碳酸铕(III)水合物CAS号: 86546-99-8 Compound CID : 91886282分子式: Eu2(CO3)3∙xH2O 分子量: 483.95(anhy)IUPAC Name: europium(3+);tricarbonate;hydrateSMILES: C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].O.[Eu+3].[Eu+3]InChIKey: ZXWSECGKSXRERD-UHFFFAOYSA-HInChI: 1S/3CH2O3.2Eu.H2O/c3*2-1(3)4;;;/h3*(H2,2,3,4);;;1H2/q;;;2*+3;/p-6
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01 反式-2-（24-二甲基苯基）环丙烷-1-羧酸CAS号: 2227783-40-4 Compound CID : 93299337分子式: C12H14O2 分子量: 190.24IUPAC Name: (1R,2R)-2-(2,4-dimethylphenyl)cyclopropane-1-carboxylic acidSMILES: CC1=CC(=C(C=C1)C2CC2C(=O)O)CInChIKey: BDCAWIWSTIEPCK-WDEREUQCSA-NInChI: 1S/C12H14O2/c1-7-3-4-9(8(2)5-7)10-6-11(10)12(13)14/h3-5,10-11H,6H2,1-2H3,(H,13,14)/t10-,11+/m0/s1
