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Molecular Formula: C79H100N29O55P7
Molecular weight: 2552.616927
InChi: InChI=1S/C79H100N29O55P7/c80-34-1-5-101(76(124)93-34)66-43(114)42(113)27(153-66)10-148-167(134,135)160-55-31(157-72(49(55)120)107-21-91-40-62(107)97-74(83)99-64(40)122)13-147-166(132,133)25-144-52-28(154-68(45(52)116)103-7-3-36(111)95-78(103)126)14-149-168(136,137)161-54-30(156-70(47(54)118)105-19-89-38-58(81)85-17-87-60(38)105)11-146-165(130,131)24-143-53-29(155-69(46(53)117)104-8-4-37(112)96-79(104)127)15-150-169(138,139)163-57-33(159-71(48(57)119)106-20-90-39-59(82)86-18-88-61(39)106)16-151-170(140,141)162-56-32(158-73(50(56)121)108-22-92-41-63(108)98-75(84)100-65(41)123)12-145-164(128,129)23-142-51-26(9-109)152-67(44(51)115)102-6-2-35(110)94-77(102)125/h1-8,17-22,26-33,42-57,66-73,109,113-121H,9-16,23-25H2,(H,128,129)(H,130,131)(H,132,133)(H,134,135)(H,136,137)(H,138,139)(H,140,141)(H2,80,93,124)(H2,81,85,87)(H2,82,86,88)(H,94,110,125)(H,95,111,126)(H,96,112,127)(H3,83,97,99,122)(H3,84,98,100,123)/t26-,27-,28-,29-,30-,31-,32-,33-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,66-,67-,68-,69-,70-,71-,72-,73-/m1/s1
InChi Key: MZIVVFBHIDOAHQ-WVPTWKIISA-N
SMILES: [C@H]1(n2c3c(nc2)c(=O)[nH]c(n3)N)[C@@H]([C@@H]([C@H](O1)COP(=O)(CO[C@H]1[C@H]([C@@H](O[C@@H]1CO)n1c(=O)[nH]c(=O)cc1)O)O)OP(=O)(OC[C@@H]1[C@H]([C@H]([C@@H](O1)n1c2c(nc1)c(ncn2)N)O)OP(=O)(OC[C@@H]1[C@H]([C@H]([C@@H](O1)n1c(=O)[nH]c(=O)cc1)O)OCP(=O)(OC[C@@H]1[C@H]([C@H]([C@@H](O1)n1c2c(nc1)c(ncn2)N)O)OP(=O)(OC[C@@H]1[C@H]([C@H]([C@@H](O1)n1c(=O)[nH]c(=O)cc1)O)OCP(=O)(OC[C@@H]1[C@H]([C@H]([C@@H](O1)n1c2c(nc1)c(=O)[nH]c(n2)N)O)OP(=O)(OC[C@@H]1[C@H]([C@H]([C@@H](O1)n1c(=O)nc(cc1)N)O)O)O)O)O)O)O)O)O
External Links
PubChem