大车前苷

CAS号
104777-68-6
CCD编号
CCD05642947
分子式
C29 H36 O16
分子量
640.587

基本信息

产品名称: 大车前苷
CAS: 104777-68-6
中文同义词: 大车前苷
英文同义词: PLANTAMAJOSIDE ; 2-(3,4-DIHYDROXYPHENYL)ETHYL-4-O-[(2E)-3-(3,4-DIHYDROXYPHENYL)PROP-2-ENOYL]-3-O-BETA-D-GLUCOPYRANOSYL-BETA-D-GLUCOPYRANOSIDE
MDL号: MFCD20527298
氢键受体数量: 16
氢键供体数量: 10
Smile: c1cc(c(cc1CCO[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)OC(=O)/C=C/c3ccc(c(c3)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O
InChi: InChI=1S/C29H36O16/c30-11-19-22(37)23(38)24(39)29(42-19)45-27-25(40)28(41-8-7-14-2-5-16(33)18(35)10-14)43-20(12-31)26(27)44-21(36)6-3-13-1-4-15(32)17(34)9-13/h1-6,9-10,19-20,22-35,37-40H,7-8,11-12H2/b6-3+/t19-,20-,22-,23+,24-,25-,26-,27-,28-,29+/m1/s1
InChiKey: InChIKey=KFEFLPDKISUVNR-QJEHNBJNSA-N

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