10-DEACETYL-7-XYLOSYLTAXOL

CAS号
CCD编号
CCD00285941
分子式
C50 H57 N O17
分子量
943.99

基本信息

产品名称: 10-DEACETYL-7-XYLOSYLTAXOL
英文同义词: 7-XYLOSYL-10-DEACETYL PACLITAXEL ; 10-DEACETYL-7-XYLOSYLTAXOL
MDL号: MFCD02094595
氢键受体数量: 18
氢键供体数量: 7
Smile: CC1=C2[C@H](C(=O)[C@@]3([C@H](C[C@@H]4[C@]([C@H]3[C@@H]([C@@](C2(C)C)(C[C@@H]1OC(=O)[C@@H]([C@H](c5ccccc5)NC(=O)c6ccccc6)O)O)OC(=O)c7ccccc7)(CO4)OC(=O)C)OC8[C@@H]([C@H]([C@@H](CO8)O)O)O)C)O
InChi: InChI=1S/C50H57NO17/c1-25-31(65-45(61)38(56)35(27-15-9-6-10-16-27)51-43(59)28-17-11-7-12-18-28)22-50(62)42(67-44(60)29-19-13-8-14-20-29)40-48(5,41(58)37(55)34(25)47(50,3)4)32(21-33-49(40,24-64-33)68-26(2)52)66-46-39(57)36(54)30(53)23-63-46/h6-20,30-33,35-40,42,46,53-57,62H,21-24H2,1-5H3,(H,51,59)/t30-,31+,32+,33-,35+,36+,37-,38-,39-,40+,42+,46?,48-,49+,50-/m1/s1
InChiKey: InChIKey=ORKLEZFXASNLFJ-YLMYHWBJSA-N

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