14BETA-BENZOYLOXY-2-DEACETYLBACCATIN VI

CAS号
705973-69-9
CCD编号
CCD05427055
分子式
C37 H46 O15
分子量
730.755

基本信息

产品名称: 14BETA-BENZOYLOXY-2-DEACETYLBACCATIN VI
CAS: 705973-69-9
英文同义词: 14BETA-BENZOYLOXY-2-DEACETYLBACCATIN VI
MDL号: MFCD20260412
氢键受体数量: 15
氢键供体数量: 2
Smile: CC1=C2[C@H]([C@@H]([C@@]3([C@H](C[C@@H]4[C@]([C@H]3[C@@H]([C@@](C2(C)C)([C@H]([C@@H]1OC(=O)C)OC(=O)c5ccccc5)O)O)(CO4)OC(=O)C)OC(=O)C)C)OC(=O)C)OC(=O)C
InChi: InChI=1S/C37H46O15/c1-17-26-28(49-20(4)40)31(50-21(5)41)35(9)24(47-18(2)38)15-25-36(16-46-25,52-22(6)42)29(35)30(43)37(45,34(26,7)8)32(27(17)48-19(3)39)51-33(44)23-13-11-10-12-14-23/h10-14,24-25,27-32,43,45H,15-16H2,1-9H3/t24-,25+,27+,28+,29-,30-,31-,32-,35+,36-,37-/m0/s1
InChiKey: InChIKey=ZZJVBWJAVYPFDJ-PRWXGGKJSA-N

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