小分子和化合物库
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甘油单油酸酯分子式: C21H40O4 分子量: 356.54IUPAC Name: 2,3-dihydroxypropyl (Z)-octadec-9-enoateSMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC(CO)OInChIKey: RZRNAYUHWVFMIP-KTKRTIGZSA-NInChI: 1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h9-10,20,22-23H,2-8,11-19H2,1H3/b10-9-
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L-丝氨酸-¹⁵NCAS号: 59935-32-9分子式: HOCH2CH(15NH2)CO2H 分子量: 106.09IUPAC Name: (2S)-2-(15N)azanyl-3-hydroxypropanoic acidSMILES: C(C(C(=O)O)N)OInChIKey: MTCFGRXMJLQNBG-GZPBOPPUSA-NInChI: 1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i4+1
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L-半胱氨酸-¹⁵NCAS号: 204523-09-1分子式: HSCH2CH(15NH2)CO2H 分子量: 122.15IUPAC Name: 2-(15N)azanyl-3-sulfanylpropanoic acidSMILES: C(C(C(=O)O)N)SInChIKey: XUJNEKJLAYXESH-AZXPZELESA-NInChI: 1S/C3H7NO2S/c4-2(1-7)3(5)6/h2,7H,1,4H2,(H,5,6)/i4+1
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L-天冬酰胺-¹⁵N₂ 一水合物CAS号: 287484-32-6分子式: H215NCOCH2CH(15NH2)CO2H·H2O 分子量: 152.12IUPAC Name: (2S)-2,4-bis(15N)(azanyl)-4-oxobutanoic acid;hydrateSMILES: C(C(C(=O)O)N)C(=O)N.OInChIKey: RBMGJIZCEWRQES-SQHSRYIDSA-NInChI: 1S/C4H8N2O3.H2O/c5-2(4(8)9)1-3(6)7;/h2H,1,5H2,(H2,6,7)(H,8,9);1H2/t2-;/m0./s1/i5+1,6+1;
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