BENZOIC ACID, 2-[[(2E)-3-(3,4-DIHYDROXYPHENYL)-1-OXO-2-PROPEN-1-YL]AMINO]-5-HYDROXY-

CAS号
116764-15-9
CCD编号
CCD08284214
分子式
C16 H13 N O6
分子量
315.28

基本信息

产品名称: BENZOIC ACID, 2-[[(2E)-3-(3,4-DIHYDROXYPHENYL)-1-OXO-2-PROPEN-1-YL]AMINO]-5-HYDROXY-
CAS: 116764-15-9
英文同义词: BENZOIC ACID, 2-[[(2E)-3-(3,4-DIHYDROXYPHENYL)-1-OXO-2-PROPEN-1-YL]AMINO]-5-HYDROXY-
MDL号: MFCD23380831
氢键受体数量: 7
氢键供体数量: 5
Smile: c1cc(c(cc1/C=C/C(=O)Nc2ccc(cc2C(=O)O)O)O)O
InChi: InChI=1S/C16H13NO6/c18-10-3-4-12(11(8-10)16(22)23)17-15(21)6-2-9-1-5-13(19)14(20)7-9/h1-8,18-20H,(H,17,21)(H,22,23)/b6-2+
InChiKey: InChIKey=IDUUXROOZBOOPH-QHHAFSJGSA-N

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