trans-3'-Hydroxy Cotinine-O-(4-deoxy-4,5-didehydro)-β-D-glucuronide Methyl Ester

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CAS号	1217540-34-5
SMILES	CN1[C@@H](C[C@H](C1=O)O[C@H]2[C@@H]([C@H](C=C(O2)C(=O)OC)O)O)c3cccnc3
Inchi	InChI=1S/C17H20N2O7/c1-19-10(9-4-3-5-18-8-9)6-12(15(19)22)25-17-14(21)11(20)7-13(26-17)16(23)24-2/h3-5,7-8,10-12,14,17,20-21H,6H2,1-2H3/t10-,11-,12+,14+,17+/m0/s1
InchiKey	CAVBICHEBRPWPW-IGXHCJPISA-N
分子式 Formula	C17H20N2O7
分子量 Molecular Weight	364.35
闪点 FP	310.1±30.1 ℃
熔点 Melting point	>45℃
沸点 Boiling point	589.2±50.0 ℃ at 760 mmHg
Polarizability极化度	34.9±0.5 10-24cm3
密度 Density	1.4±0.1 g/cm3
蒸汽压 Vapor Pressure	0.0±1.7 mmHg at 25℃
溶解度Solubility	Chloroform (Slightly), Dichloromethane (Slightly), Methanol (Slightly)
储藏条件 Storage conditions	-20?℃ Freezer