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Search Hits Limit:
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Found 11 results

Search term: MF = 'C_{80}H_{113}ClN_{18}O_{13}'
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17287671

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C80H113ClN18O13/c1-9-84-79(85-10-2)88-38-17-15-24-60(70(104)94-62(41-49(5)6)71(105)93-61(25-16-18-39-89-80(86-11-3)87-12-4)78(112)99-40-20-26-68(99)77(111)90-50(7)69(82)103)92-73(107)64(44-53-30-35-59(102)36-31-53)97-76(110)67(48-100)98-75(109)66(46-55-21-19-37-83-47-55)96-74(108)65(43-52-28-33-58(81)34-29-52)95-72(106)63(91-51(8)101)45-54-27-32-56-22-13-14-23-57(56)42-54/h13-14,19,21-23,27-37,42,47,49-50,60-68,100,102H,9-12,15-18,20,24-26,38-41,43-46,48H2,1-8H3,(H2,82,103)(H,90,111)(H,91,101)(H,92,107)(H,93,105)(H,94,104)(H,95,106)(H,96,108)(H,97,110)(H,98,109)(H2,84,85,88)(H2,86,87,89)/t50-,60-,61+,62+,63-,64+,65-,66-,67+,68+/m1/s1
C80H113ClN18O131570.319323900
17287680

8 of 10 defined stereocentres - 8/10 defined
InChI=1/C80H113ClN18O13/c1-9-84-79(85-10-2)88-38-17-15-24-60(70(104)94-62(41-49(5)6)71(105)93-61(25-16-18-39-89-80(86-11-3)87-12-4)78(112)99-40-20-26-68(99)77(111)90-50(7)69(82)103)92-73(107)64(44-53-30-35-59(102)36-31-53)97-76(110)67(48-100)98-75(109)66(46-55-21-19-37-83-47-55)96-74(108)65(43-52-28-33-58(81)34-29-52)95-72(106)63(91-51(8)101)45-54-27-32-56-22-13-14-23-57(56)42-54/h13-14,19,21-23,27-37,42,47,49-50,60-68,100,102H,9-12,15-18,20,24-26,38-41,43-46,48H2,1-8H3,(H2,82,103)(H,90,111)(H,91,101)(H,92,107)(H,93,105)(H,94,104)(H,95,106)(H,96,108)(H,97,110)(H,98,109)(H2,84,85,88)(H2,86,87,89)/t50-,60-,61+,62+,63?,64-,65+,66+,67-,68?/m1/s1
C80H113ClN18O131570.3198800
16736620

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C80H113ClN18O13/c1-9-84-79(85-10-2)88-39-17-15-27-60(70(104)94-62(42-49(5)6)71(105)93-61(28-16-18-40-89-80(86-11-3)87-12-4)78(112)99-41-21-29-68(99)77(111)90-50(7)69(82)103)92-72(106)63(44-53-32-36-58(102)37-33-53)97-76(110)67(48-100)98-74(108)65(45-54-22-20-38-83-47-54)96-73(107)64(43-52-30-34-57(81)35-31-52)95-75(109)66(91-51(8)101)46-56-25-19-24-55-23-13-14-26-59(55)56/h13-14,19-20,22-26,30-38,47,49-50,60-68,100,102H,9-12,15-18,21,27-29,39-46,48H2,1-8H3,(H2,82,103)(H,90,111)(H,91,101)(H,92,106)(H,93,105)(H,94,104)(H,95,109)(H,96,107)(H,97,110)(H,98,108)(H2,84,85,88)(H2,86,87,89)/t50-,60-,61+,62+,63+,64-,65-,66-,67+,68+/m1/s1
C80H113ClN18O131570.3195600
23208004

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C80H113ClN18O13/c1-7-9-36-86-79(83)88-38-15-13-22-60(70(104)94-62(41-49(3)4)71(105)93-61(23-14-16-39-89-80(84)87-37-10-8-2)78(112)99-40-18-24-68(99)77(111)90-50(5)69(82)103)92-73(107)64(44-53-28-33-59(102)34-29-53)97-76(110)67(48-100)98-75(109)66(46-55-19-17-35-85-47-55)96-74(108)65(43-52-26-31-58(81)32-27-52)95-72(106)63(91-51(6)101)45-54-25-30-56-20-11-12-21-57(56)42-54/h11-12,17,19-21,25-35,42,47,49-50,60-68,100,102H,7-10,13-16,18,22-24,36-41,43-46,48H2,1-6H3,(H2,82,103)(H,90,111)(H,91,101)(H,92,107)(H,93,105)(H,94,104)(H,95,106)(H,96,108)(H,97,110)(H,98,109)(H3,83,86,88)(H3,84,87,89)/t50-,60-,61+,62+,63-,64+,65-,66-,67+,68+/m1/s1
C80H113ClN18O131570.3193200
23208005

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C80H113ClN18O13/c1-9-84-79(85-10-2)88-38-17-15-24-60(70(104)94-62(41-49(5)6)71(105)93-61(25-16-18-39-89-80(86-11-3)87-12-4)78(112)99-40-20-26-68(99)77(111)90-50(7)69(82)103)92-73(107)64(44-53-30-35-59(102)36-31-53)97-76(110)67(48-100)98-75(109)66(46-55-21-19-37-83-47-55)96-74(108)65(43-52-28-33-58(81)34-29-52)95-72(106)63(91-51(8)101)45-54-27-32-56-22-13-14-23-57(56)42-54/h13-14,19,21-23,27-37,42,47,49-50,60-68,100,102H,9-12,15-18,20,24-26,38-41,43-46,48H2,1-8H3,(H2,82,103)(H,90,111)(H,91,101)(H,92,107)(H,93,105)(H,94,104)(H,95,106)(H,96,108)(H,97,110)(H,98,109)(H2,84,85,88)(H2,86,87,89)/t50-,60+,61+,62+,63-,64+,65-,66-,67+,68+/m1/s1
C80H113ClN18O131570.3193200
24958659

0 of 10 defined stereocentres - 0/10 defined
InChI=1/C80H113ClN18O13/c1-9-84-79(85-10-2)88-38-17-15-24-60(70(104)94-62(41-49(5)6)71(105)93-61(25-16-18-39-89-80(86-11-3)87-12-4)78(112)99-40-20-26-68(99)77(111)90-50(7)69(82)103)92-73(107)64(44-53-30-35-59(102)36-31-53)97-76(110)67(48-100)98-75(109)66(46-55-21-19-37-83-47-55)96-74(108)65(43-52-28-33-58(81)34-29-52)95-72(106)63(91-51(8)101)45-54-27-32-56-22-13-14-23-57(56)42-54/h13-14,19,21-23,27-37,42,47,49-50,60-68,100,102H,9-12,15-18,20,24-26,38-41,43-46,48H2,1-8H3,(H2,82,103)(H,90,111)(H,91,101)(H,92,107)(H,93,105)(H,94,104)(H,95,106)(H,96,108)(H,97,110)(H,98,109)(H2,84,85,88)(H2,86,87,89)
C80H113ClN18O131570.3192200
30845305

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C80H113ClN18O13/c1-9-97(10-2)79(83)86-38-17-15-24-60(70(104)92-62(41-49(5)6)71(105)91-61(25-16-18-39-87-80(84)98(11-3)12-4)78(112)99-40-20-26-68(99)77(111)88-50(7)69(82)103)90-73(107)64(44-53-30-35-59(102)36-31-53)95-76(110)67(48-100)96-75(109)66(46-55-21-19-37-85-47-55)94-74(108)65(43-52-28-33-58(81)34-29-52)93-72(106)63(89-51(8)101)45-54-27-32-56-22-13-14-23-57(56)42-54/h13-14,19,21-23,27-37,42,47,49-50,60-68,100,102H,9-12,15-18,20,24-26,38-41,43-46,48H2,1-8H3,(H2,82,103)(H2,83,86)(H2,84,87)(H,88,111)(H,89,101)(H,90,107)(H,91,105)(H,92,104)(H,93,106)(H,94,108)(H,95,110)(H,96,109)/t50-,60+,61-,62-,63+,64-,65-,66+,67-,68+/m0/s1
C80H113ClN18O131570.3192200
114816651

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C80H113ClN18O13/c1-9-84-79(85-10-2)88-38-17-15-24-60(70(104)94-62(41-49(5)6)71(105)93-61(25-16-18-39-89-80(86-11-3)87-12-4)78(112)99-40-20-26-68(99)77(111)90-50(7)69(82)103)92-73(107)64(44-53-30-35-59(102)36-31-53)97-76(110)67(48-100)98-75(109)66(46-55-21-19-37-83-47-55)96-74(108)65(43-52-28-33-58(81)34-29-52)95-72(106)63(91-51(8)101)45-54-27-32-56-22-13-14-23-57(56)42-54/h13-14,19,21-23,27-37,42,47,49-50,60-68,100,102H,9-12,15-18,20,24-26,38-41,43-46,48H2,1-8H3,(H2,82,103)(H,90,111)(H,91,101)(H,92,107)(H,93,105)(H,94,104)(H,95,106)(H,96,108)(H,97,110)(H,98,109)(H2,84,85,88)(H2,86,87,89)/t50-,60-,61+,62+,63-,64+,65-,66-,67+,68-/m1/s1
C80H113ClN18O131570.3191100
17290393

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C80H113ClN18O13/c1-9-84-79(85-10-2)88-38-17-15-24-60(70(104)94-62(41-49(5)6)71(105)93-61(25-16-18-39-89-80(86-11-3)87-12-4)78(112)99-40-20-26-68(99)77(111)90-50(7)69(82)103)92-73(107)64(44-53-30-35-59(102)36-31-53)97-76(110)67(48-100)98-75(109)66(46-55-21-19-37-83-47-55)96-74(108)65(43-52-28-33-58(81)34-29-52)95-72(106)63(91-51(8)101)45-54-27-32-56-22-13-14-23-57(56)42-54/h13-14,19,21-23,27-37,42,47,49-50,60-68,100,102H,9-12,15-18,20,24-26,38-41,43-46,48H2,1-8H3,(H2,82,103)(H,90,111)(H,91,101)(H,92,107)(H,93,105)(H,94,104)(H,95,106)(H,96,108)(H,97,110)(H,98,109)(H2,84,85,88)(H2,86,87,89)/t50-,60-,61+,62+,63-,64-,65-,66-,67+,68+/m1/s1
C80H113ClN18O131570.3191100
17291051

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C80H113ClN18O13/c1-9-84-79(85-10-2)88-38-17-15-24-60(70(104)94-62(41-49(5)6)71(105)93-61(25-16-18-39-89-80(86-11-3)87-12-4)78(112)99-40-20-26-68(99)77(111)90-50(7)69(82)103)92-73(107)64(44-53-30-35-59(102)36-31-53)97-76(110)67(48-100)98-75(109)66(46-55-21-19-37-83-47-55)96-74(108)65(43-52-28-33-58(81)34-29-52)95-72(106)63(91-51(8)101)45-54-27-32-56-22-13-14-23-57(56)42-54/h13-14,19,21-23,27-37,42,47,49-50,60-68,100,102H,9-12,15-18,20,24-26,38-41,43-46,48H2,1-8H3,(H2,82,103)(H,90,111)(H,91,101)(H,92,107)(H,93,105)(H,94,104)(H,95,106)(H,96,108)(H,97,110)(H,98,109)(H2,84,85,88)(H2,86,87,89)/t50-,60-,61+,62+,63-,64+,65+,66-,67+,68+/m1/s1
C80H113ClN18O131570.3191100
21258025

10 of 10 defined stereocentres - 10/10 defined
InChI=1/C80H113ClN18O13/c1-9-87-78(88-10-2)91-39-17-15-27-59(82)69(104)94-64(42-49(5)6)74(109)98(75(110)65(45-52-32-36-57(102)37-33-52)95-71(106)66(48-100)96-70(105)61(84)44-53-22-20-38-86-47-53)77(112)80(8,68(103)63(93-50(7)101)46-55-25-19-24-54-23-13-14-26-58(54)55)99(73(108)62(85)43-51-30-34-56(81)35-31-51)76(111)67-29-21-41-97(67)72(107)60(83)28-16-18-40-92-79(89-11-3)90-12-4/h13-14,19-20,22-26,30-38,47,49,59-67,100,102H,9-12,15-18,21,27-29,39-46,48,82-85H2,1-8H3,(H,93,101)(H,94,104)(H,95,106)(H,96,105)(H2,87,88,91)(H2,89,90,92)/t59-,60+,61-,62-,63-,64+,65+,66+,67+,80+/m1/s1
C80H113ClN18O131570.3191100

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