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Molecular Formula: C70H116N12O42S2
Molecular weight: 1861.85524
InChi: InChI=1S/C70H116N12O42S2/c1-19(89)73-37-51(105)45(99)29(11-83)115-63(37)111-17-35-57(121-65-39(75-21(3)91)53(107)47(101)31(13-85)117-65)59(123-67-41(77-23(5)93)55(109)49(103)33(15-87)119-67)43(79-25(7)95)61(113-35)81-69(125)71-9-27(97)28(98)10-72-70(126)82-62-44(80-26(8)96)60(124-68-42(78-24(6)94)56(110)50(104)34(16-88)120-68)58(122-66-40(76-22(4)92)54(108)48(102)32(14-86)118-66)36(114-62)18-112-64-38(74-20(2)90)52(106)46(100)30(12-84)116-64/h29-68,83-88,97-110H,9-18H2,1-8H3,(H,73,89)(H,74,90)(H,75,91)(H,76,92)(H,77,93)(H,78,94)(H,79,95)(H,80,96)(H2,71,81,125)(H2,72,82,126)/b28-27+/t29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-,65+,66+,67+,68+/m1/s1
InChi Key: HOTVUJVIMUWPDF-QIKAKVDISA-N
SMILES: [C@@H]1([C@@H]([C@H](O[C@H]([C@@H]1NC(=O)C)NC(=S)NC/C(=C(/CNC(=S)N[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)NC(=O)C)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)NC(=O)C)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)NC(=O)C)NC(=O)C)\O)/O)CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)NC(=O)C)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)NC(=O)C)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)NC(=O)C
External Links
PubChem