ECHELON C-35F6

CAS号
CCD编号
CCD05226700
分子式
C37 H59 B F2 N3 O20 P3 . C6 H15 N
分子量
1108.79

基本信息

产品名称: ECHELON C-35F6
英文同义词: ECHELON C-35F6
MDL号: MFCD19705444
氢键受体数量: 23
氢键供体数量: 9
Smile: [B-]1(n2c(ccc2CCCCC(=O)NCCCCCC(=O)OC[C@H](COP(=O)(O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H]([C@H]3O)OP(=O)(O)O)O)OP(=O)(O)O)O)OC(=O)CCCCC)C=C4[N+]1=C(C=C4C)C)(F)F.CCN(CC)CC
InChi: InChI=1S/C37H59BF2N3O20P3.C6H15N/c1-4-5-7-15-31(46)60-27(22-59-66(56,57)63-37-33(48)35(61-64(50,51)52)32(47)36(34(37)49)62-65(53,54)55)21-58-30(45)14-8-6-11-18-41-29(44)13-10-9-12-25-16-17-26-20-28-23(2)19-24(3)42(28)38(39,40)43(25)26;1-4-7(5-2)6-3/h16-17,19-20,27,32-37,47-49H,4-15,18,21-22H2,1-3H3,(H,41,44)(H,56,57)(H2,50,51,52)(H2,53,54,55);4-6H2,1-3H3/t27-,32-,33-,34-,35-,36+,37-;/m1./s1
InChiKey: InChIKey=VRARMHRQIRSYID-XGESOJSCSA-N

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