Standard InChI |
InChI=1S/C76H100BrN16O27/c1-35(17-18-38-11-6-4-7-12-38)23-51(98)44-27-56(102)82-49(31-94)69(112)87-48-30-92-29-42(93(34-92)75-63(106)62(105)60(103)53(33-96)120-75)25-46(66(109)90-58(37(3)97)73(116)88-50(32-95)70(113)85-45(65(108)84-44)24-39-13-8-5-9-14-39)81-55(101)16-10-15-43(76(118)119)83-71(114)52(99)28-80-72(115)57(36(2)40-19-21-41(77)22-20-40)89-74(117)59(61(104)64(79)107)91-67(110)47(26-54(78)100)86-68(48)111/h4-9,11-14,17-23,29,34,36-37,43-53,57-63,75,94-99,103-106H,10,15-16,24-28,30-33H2,1-3H3,(H2,78,100)(H2,79,107)(H,80,115)(H,81,101)(H,82,102)(H,83,114)(H,84,108)(H,85,113)(H,86,111)(H,87,112)(H,88,116)(H,89,117)(H,90,109)(H,91,110)(H,118,119)/b18-17+,35-23+/t36-,37-,43-,44?,45-,46+,47-,48-,49-,50-,51-,52+,53+,57?,58?,59?,60-,61+,62-,63+,75+/m0/s1 |
Standard InChI (Main Layer) |
InChI=1S/C76H100BrN16O27/c1-35(17-18-38-11-6-4-7-12-38)23-51(98)44-27-56(102)82-49(31-94)69(112)87-48-30-92-29-42(93(34-92)75-63(106)62(105)60(103)53(33-96)120-75)25-46(66(109)90-58(37(3)97)73(116)88-50(32-95)70(113)85-45(65(108)84-44)24-39-13-8-5-9-14-39)81-55(101)16-10-15-43(76(118)119)83-71(114)52(99)28-80-72(115)57(36(2)40-19-21-41(77)22-20-40)89-74(117)59(61(104)64(79)107)91-67(110)47(26-54(78)100)86-68(48)111/h4-9,11-14,17-23,29,34,36-37,43-53,57-63,75,94-99,103-106H,10,15-16,24-28,30-33H2,1-3H3,(H2,78,100)(H2,79,107)(H,80,115)(H,81,101)(H,82,102)(H,83,114)(H,84,108)(H,85,113)(H,86,111)(H,87,112)(H,88,116)(H,89,117)(H,90,109)(H,91,110)(H,118,119) |