基本信息 |
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产品名称: | 2-[[8-[[3-[(5-氯-2,6-二氟-4-嘧啶基)氨基]苯甲酰基]氨基]-1-羟基-3,6-二磺酸基-2-萘基]偶氮]萘-1,5-二磺酸四钠 |
CAS: | 68238-92-6 |
中文同义词: | 2-[[8-[[3-[(5-氯-2,6-二氟-4-嘧啶基)氨基]苯甲酰基]氨基]-1-羟基-3,6-二磺酸基-2-萘基]偶氮]萘-1,5-二磺酸四钠 |
英文同义词: | TETRASODIUM 2-[[8-[[3-[(5-CHLORO-2,6-DIFLUORO-4-PYRIMIDINYL)AMINO]BENZOYL]AMINO]-1-HYDROXY-3,6-DISULPHONATO-2-NAPHTHYL]AZO]NAPHTHALENE-1,5-DISULPHONATE |
MDL号: | MFCD23142808 |
氢键受体数量: | 20 |
氢键供体数量: | 3 |
Smile: | c1cc(cc(c1)Nc2c(c(nc(n2)F)F)Cl)C(=O)Nc3cc(cc4c3c(c(c(c4)S(=O)(=O)[O-])/N=N/c5ccc6c(c5S(=O)(=O)[O-])cccc6S(=O)(=O)[O-])O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+] |
InChi: | InChI=1S/C31H19ClF2N6O14S4.4Na/c32-24-28(33)37-31(34)38-29(24)35-15-4-1-3-13(9-15)30(42)36-20-12-16(55(43,44)45)10-14-11-22(57(49,50)51)25(26(41)23(14)20)40-39-19-8-7-17-18(27(19)58(52,53)54)5-2-6-21(17)56(46,47)48;;;;/h1-12,41H,(H,36,42)(H,35,37,38)(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54);;;;/q;4*+1/p-4/b40-39+;;;; |
InChiKey: | InChIKey=KFZGCQOLFVUWBZ-RJOFBDMQSA-J |
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