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HEPTAKIS-(3,6-DIAMINO-3,6-DI-N-CHLOROACETYL-3,6-DIDEOXY)-BETA-CYCLOALTRIN
SpectraBase Compound ID 75C9DGkEtQ1
InChI InChI=1S/C70H98Cl14N14O35/c71-1-29(99)85-15-22-57-43(92-36(106)8-78)50(113)64(120-22)128-58-23(16-86-30(100)2-72)122-66(52(115)45(58)94-38(108)10-80)130-60-25(18-88-32(102)4-74)124-68(54(117)47(60)96-40(110)12-82)132-62-27(20-90-34(104)6-76)126-70(56(119)49(62)98-42(112)14-84)133-63-28(21-91-35(105)7-77)125-69(55(118)48(63)97-41(111)13-83)131-61-26(19-89-33(103)5-75)123-67(53(116)46(61)95-39(109)11-81)129-59-24(17-87-31(101)3-73)121-65(127-57)51(114)44(59)93-37(107)9-79/h22-28,43-70,113-119H,1-21H2,(H,85,99)(H,86,100)(H,87,101)(H,88,102)(H,89,103)(H,90,104)(H,91,105)(H,92,106)(H,93,107)(H,94,108)(H,95,109)(H,96,110)(H,97,111)(H,98,112)/t22-,23-,24-,25-,26-,27-,28-,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-,69-,70-/m0/s1
InChIKey VLQKVPFPCNSZNK-OMERRESKSA-N
Mol Weight 2192.0 g/mol
Molecular Formula C70H98Cl14N14O35
Exact Mass 2184.195839 g/mol
Enantiomer InChIKey VLQKVPFPCNSZNK-HXGFYOBSSA-N
Unknown Identification

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