Debug Info

SpectraBase Compound ID KUmn6W0A5Ne
InChI InChI=1S/C71H121N3O53S/c75-7-20-30(85)33(88)43(98)60(112-20)108-16-71(17-109-61-44(99)34(89)31(86)21(8-76)113-61,18-110-62-45(100)35(90)32(87)22(9-77)114-62)74-29(84)4-2-1-3-5-72-70(128)73-6-19-53-36(91)46(101)63(111-19)122-54-23(10-78)116-65(48(103)38(54)93)124-56-25(12-80)118-67(50(105)40(56)95)126-58-27(14-82)120-69(52(107)42(58)97)127-59-28(15-83)119-68(51(106)41(59)96)125-57-26(13-81)117-66(49(104)39(57)94)123-55-24(11-79)115-64(121-53)47(102)37(55)92/h19-28,30-69,75-83,85-107H,1-18H2,(H,74,84)(H2,72,73,128)/t19-,20-,21-,22-,23-,24-,25-,26+,27-,28-,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-,69-/m0/s1
InChIKey IBIFQVNYQCCRHY-IFOSQBISSA-N
Mol Weight 1896.8 g/mol
Molecular Formula C71H121N3O53S
Exact Mass 1895.658597 g/mol
Enantiomer InChIKey IBIFQVNYQCCRHY-BQUPRWDNSA-N
Unknown Identification

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