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E.g. C7H(10-14)O(0-4)

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±
(example: 123 ± 1)

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±

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Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 26 results

Search term: MF = 'C_{52}H_{98}N_{16}O_{13}'
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4470591

12 of 13 defined stereocentres - 12/13 defined
InChI=1/C52H98N16O13/c1-9-29(6)11-10-12-40(71)59-32(13-19-53)47(76)68-42(31(8)70)52(81)64-35(16-22-56)44(73)63-37-18-24-58-51(80)41(30(7)69)67-48(77)36(17-23-57)61-43(72)33(14-20-54)62-49(78)38(25-27(2)3)66-50(79)39(26-28(4)5)65-45(74)34(15-21-55)60-46(37)75/h27-39,41-42,69-70H,9-26,53-57H2,1-8H3,(H,58,80)(H,59,71)(H,60,75)(H,61,72)(H,62,78)(H,63,73)(H,64,81)(H,65,74)(H,66,79)(H,67,77)(H,68,76)/t29?,30-,31-,32+,33+,34+,35+,36+,37+,38+,39-,41+,42+/m1/s1
C52H98N16O131155.43392262210
24678450

12 of 12 defined stereocentres - 12/12 defined
InChI=1/C52H98N16O13/c1-27(2)11-9-10-12-40(71)59-32(13-19-53)47(76)68-42(31(8)70)52(81)64-35(16-22-56)44(73)63-37-18-24-58-51(80)41(30(7)69)67-48(77)36(17-23-57)61-43(72)33(14-20-54)62-49(78)38(25-28(3)4)66-50(79)39(26-29(5)6)65-45(74)34(15-21-55)60-46(37)75/h27-39,41-42,69-70H,9-26,53-57H2,1-8H3,(H,58,80)(H,59,71)(H,60,75)(H,61,72)(H,62,78)(H,63,73)(H,64,81)(H,65,74)(H,66,79)(H,67,77)(H,68,76)/t30-,31-,32+,33+,34+,35+,36+,37+,38+,39-,41+,42+/m1/s1
C52H98N16O131155.433991200
66000712

11 of 13 defined stereocentres - 11/13 defined
InChI=1/C52H98N16O13/c1-9-29(6)11-10-12-40(71)59-32(13-19-53)47(76)68-42(31(8)70)52(81)64-35(16-22-56)44(73)63-37-18-24-58-51(80)41(30(7)69)67-48(77)36(17-23-57)61-43(72)33(14-20-54)62-49(78)38(25-27(2)3)66-50(79)39(26-28(4)5)65-45(74)34(15-21-55)60-46(37)75/h27-39,41-42,69-70H,9-26,53-57H2,1-8H3,(H,58,80)(H,59,71)(H,60,75)(H,61,72)(H,62,78)(H,63,73)(H,64,81)(H,65,74)(H,66,79)(H,67,77)(H,68,76)/t29?,30-,31-,32+,33+,34+,35+,36-,37+,38-,39-,41?,42+/m1/s1
C52H98N16O131155.433959700
8549505

13 of 13 defined stereocentres - 13/13 defined
InChI=1/C52H98N16O13/c1-9-29(6)40-51(80)63-34(16-22-55)43(72)61-36(18-24-57)48(77)67-41(30(7)69)50(79)58-25-19-37(46(75)60-33(15-21-54)45(74)65-38(26-28(4)5)49(78)66-40)62-44(73)35(17-23-56)64-52(81)42(31(8)70)68-47(76)32(14-20-53)59-39(71)13-11-10-12-27(2)3/h27-38,40-42,69-70H,9-26,53-57H2,1-8H3,(H,58,79)(H,59,71)(H,60,75)(H,61,72)(H,62,73)(H,63,80)(H,64,81)(H,65,74)(H,66,78)(H,67,77)(H,68,76)/t29-,30+,31+,32-,33-,34-,35-,36-,37-,38+,40-,41-,42-/m0/s1
C52H98N16O131155.43395500
4932463

6 of 12 defined stereocentres - 6/12 defined
InChI=1/C52H98N16O13/c1-27(2)11-9-10-12-40(71)59-32(13-19-53)47(76)68-42(31(8)70)52(81)64-35(16-22-56)44(73)63-37-18-24-58-51(80)41(30(7)69)67-48(77)36(17-23-57)61-43(72)33(14-20-54)62-49(78)38(25-28(3)4)66-50(79)39(26-29(5)6)65-45(74)34(15-21-55)60-46(37)75/h27-39,41-42,69-70H,9-26,53-57H2,1-8H3,(H,58,80)(H,59,71)(H,60,75)(H,61,72)(H,62,78)(H,63,73)(H,64,81)(H,65,74)(H,66,79)(H,67,77)(H,68,76)/t30-,31-,32?,33?,34?,35?,36?,37?,38-,39-,41+,42-/m1/s1
C52H98N16O131155.43394300
7988146

0 of 12 defined stereocentres - 0/12 defined
InChI=1/C52H98N16O13/c1-27(2)11-9-10-12-40(71)59-32(13-19-53)47(76)68-42(31(8)70)52(81)64-35(16-22-56)44(73)63-37-18-24-58-51(80)41(30(7)69)67-48(77)36(17-23-57)61-43(72)33(14-20-54)62-49(78)38(25-28(3)4)66-50(79)39(26-29(5)6)65-45(74)34(15-21-55)60-46(37)75/h27-39,41-42,69-70H,9-26,53-57H2,1-8H3,(H,58,80)(H,59,71)(H,60,75)(H,61,72)(H,62,78)(H,63,73)(H,64,81)(H,65,74)(H,66,79)(H,67,77)(H,68,76)
C52H98N16O131155.433924400
58768

9 of 13 defined stereocentres - 9/13 defined
InChI=1/C52H98N16O13/c1-9-29(6)40-51(80)63-34(16-22-55)43(72)61-36(18-24-57)48(77)67-41(30(7)69)50(79)58-25-19-37(46(75)60-33(15-21-54)45(74)65-38(26-28(4)5)49(78)66-40)62-44(73)35(17-23-56)64-52(81)42(31(8)70)68-47(76)32(14-20-53)59-39(71)13-11-10-12-27(2)3/h27-38,40-42,69-70H,9-26,53-57H2,1-8H3,(H,58,79)(H,59,71)(H,60,75)(H,61,72)(H,62,73)(H,63,80)(H,64,81)(H,65,74)(H,66,78)(H,67,77)(H,68,76)/t29-,30+,31+,32-,33-,34-,35?,36+,37-,38-,40?,41?,42?/m0/s1
C52H98N16O131155.43393300
24021546

0 of 13 defined stereocentres - 0/13 defined
InChI=1/C52H98N16O13/c1-9-29(6)11-10-12-40(71)59-32(13-19-53)47(76)68-42(31(8)70)52(81)64-35(16-22-56)44(73)63-37-18-24-58-51(80)41(30(7)69)67-48(77)36(17-23-57)61-43(72)33(14-20-54)62-49(78)38(25-27(2)3)66-50(79)39(26-28(4)5)65-45(74)34(15-21-55)60-46(37)75/h27-39,41-42,69-70H,9-26,53-57H2,1-8H3,(H,58,80)(H,59,71)(H,60,75)(H,61,72)(H,62,78)(H,63,73)(H,64,81)(H,65,74)(H,66,79)(H,67,77)(H,68,76)
C52H98N16O131155.43393100
5034815

12 of 12 defined stereocentres - 12/12 defined
InChI=1/C52H98N16O13/c1-27(2)11-9-10-12-40(71)60-33(13-19-53)49(78)68-42(31(8)70)52(81)65-36(16-22-56)46(75)64-38-18-24-58-51(80)41(30(7)69)67-50(79)37(17-23-57)63-45(74)34(14-20-54)61-43(72)32(29(5)6)26-59-44(73)39(25-28(3)4)66-47(76)35(15-21-55)62-48(38)77/h27-39,41-42,69-70H,9-26,53-57H2,1-8H3,(H,58,80)(H,59,73)(H,60,71)(H,61,72)(H,62,77)(H,63,74)(H,64,75)(H,65,81)(H,66,76)(H,67,79)(H,68,78)/t30-,31-,32+,33-,34+,35+,36-,37+,38-,39-,41+,42+/m1/s1
C52H98N16O131155.43393200
24684723

12 of 13 defined stereocentres - 12/13 defined
InChI=1/C52H98N16O13/c1-9-29(6)11-10-12-40(71)59-32(13-19-53)47(76)68-42(31(8)70)52(81)64-35(16-22-56)44(73)63-37-18-24-58-51(80)41(30(7)69)67-48(77)36(17-23-57)61-43(72)33(14-20-54)62-49(78)38(25-27(2)3)66-50(79)39(26-28(4)5)65-45(74)34(15-21-55)60-46(37)75/h27-39,41-42,69-70H,9-26,53-57H2,1-8H3,(H,58,80)(H,59,71)(H,60,75)(H,61,72)(H,62,78)(H,63,73)(H,64,81)(H,65,74)(H,66,79)(H,67,77)(H,68,76)/t29?,30-,31+,32-,33-,34-,35-,36-,37-,38-,39+,41-,42-/m0/s1
C52H98N16O131155.43393400
76767390

12 of 13 defined stereocentres - 12/13 defined
InChI=1/C52H98N16O13/c1-9-29(6)11-10-12-40(71)59-32(13-19-53)47(76)68-42(31(8)70)52(81)64-35(16-22-56)44(73)63-37-18-24-58-51(80)41(30(7)69)67-48(77)36(17-23-57)61-43(72)33(14-20-54)62-49(78)38(25-27(2)3)66-50(79)39(26-28(4)5)65-45(74)34(15-21-55)60-46(37)75/h27-39,41-42,69-70H,9-26,53-57H2,1-8H3,(H,58,80)(H,59,71)(H,60,75)(H,61,72)(H,62,78)(H,63,73)(H,64,81)(H,65,74)(H,66,79)(H,67,77)(H,68,76)/t29?,30-,31-,32+,33+,34+,35+,36+,37+,38+,39+,41+,42+/m1/s1
C52H98N16O131155.43392200
76799383

11 of 13 defined stereocentres - 11/13 defined
InChI=1/C52H98N16O13/c1-9-29(6)11-10-12-40(71)59-32(13-19-53)47(76)68-42(31(8)70)52(81)64-35(16-22-56)44(73)63-37-18-24-58-51(80)41(30(7)69)67-48(77)36(17-23-57)61-43(72)33(14-20-54)62-49(78)38(25-27(2)3)66-50(79)39(26-28(4)5)65-45(74)34(15-21-55)60-46(37)75/h27-39,41-42,69-70H,9-26,53-57H2,1-8H3,(H,58,80)(H,59,71)(H,60,75)(H,61,72)(H,62,78)(H,63,73)(H,64,81)(H,65,74)(H,66,79)(H,67,77)(H,68,76)/t29?,30-,31-,32+,33+,34?,35+,36+,37+,38+,39-,41+,42+/m1/s1
C52H98N16O131155.43392200
8733608

12 of 12 defined stereocentres - 12/12 defined
InChI=1/C52H98N16O13/c1-27(2)11-9-10-12-40(71)59-33(14-20-54)47(76)67-41(30(7)69)51(80)63-32(13-19-53)43(72)58-24-18-37-46(75)66-39(26-29(5)6)50(79)62-35(16-22-56)45(74)65-38(25-28(3)4)49(78)61-34(15-21-55)44(73)60-36(17-23-57)48(77)68-42(31(8)70)52(81)64-37/h27-39,41-42,69-70H,9-26,53-57H2,1-8H3,(H,58,72)(H,59,71)(H,60,73)(H,61,78)(H,62,79)(H,63,80)(H,64,81)(H,65,74)(H,66,75)(H,67,76)(H,68,77)/t30-,31-,32+,33+,34+,35+,36+,37+,38+,39-,41+,42+/m1/s1
C52H98N16O131155.43392100
8853118

12 of 13 defined stereocentres - 12/13 defined
InChI=1/C52H98N16O13/c1-9-29(6)12-10-11-13-39(71)59-33(15-21-54)46(75)67-41(30(7)69)51(80)62-32(14-20-53)43(72)58-25-19-37-45(74)65-38(26-27(2)3)49(78)61-35(17-23-56)47(76)66-40(28(4)5)50(79)63-34(16-22-55)44(73)60-36(18-24-57)48(77)68-42(31(8)70)52(81)64-37/h27-38,40-42,69-70H,9-26,53-57H2,1-8H3,(H,58,72)(H,59,71)(H,60,73)(H,61,78)(H,62,80)(H,63,79)(H,64,81)(H,65,74)(H,66,76)(H,67,75)(H,68,77)/t29?,30-,31-,32+,33+,34+,35+,36+,37+,38-,40+,41+,42+/m1/s1
C52H98N16O131155.43392100
8924134

13 of 13 defined stereocentres - 13/13 defined
InChI=1/C52H98N16O13/c1-9-29(6)40-50(79)63-34(16-22-55)44(73)60-36(18-24-57)48(77)68-42(31(8)70)52(81)64-37(45(74)65-38(26-28(4)5)49(78)61-35(17-23-56)47(76)66-40)19-25-58-43(72)32(14-20-53)62-51(80)41(30(7)69)67-46(75)33(15-21-54)59-39(71)13-11-10-12-27(2)3/h27-38,40-42,69-70H,9-26,53-57H2,1-8H3,(H,58,72)(H,59,71)(H,60,73)(H,61,78)(H,62,80)(H,63,79)(H,64,81)(H,65,74)(H,66,76)(H,67,75)(H,68,77)/t29-,30+,31+,32-,33-,34-,35-,36-,37-,38+,40-,41-,42-/m0/s1
C52H98N16O131155.43392100
9095539

12 of 12 defined stereocentres - 12/12 defined
InChI=1/C52H98N16O13/c1-27(2)12-10-9-11-13-39(71)59-33(15-21-54)46(75)67-41(30(7)69)51(80)62-32(14-20-53)43(72)58-25-19-37-45(74)65-38(26-28(3)4)49(78)61-35(17-23-56)47(76)66-40(29(5)6)50(79)63-34(16-22-55)44(73)60-36(18-24-57)48(77)68-42(31(8)70)52(81)64-37/h27-38,40-42,69-70H,9-26,53-57H2,1-8H3,(H,58,72)(H,59,71)(H,60,73)(H,61,78)(H,62,80)(H,63,79)(H,64,81)(H,65,74)(H,66,76)(H,67,75)(H,68,77)/t30-,31-,32+,33+,34+,35+,36+,37+,38-,40+,41+,42+/m1/s1
C52H98N16O131155.43392100
5036586

12 of 12 defined stereocentres - 12/12 defined
InChI=1/C52H98N16O13/c1-27(2)11-9-10-12-40(71)60-33(13-19-53)49(78)68-42(31(8)70)52(81)65-36(16-22-56)46(75)64-38-18-24-58-51(80)41(30(7)69)67-50(79)37(17-23-57)63-45(74)34(14-20-54)61-43(72)32(29(5)6)26-59-44(73)39(25-28(3)4)66-47(76)35(15-21-55)62-48(38)77/h27-39,41-42,69-70H,9-26,53-57H2,1-8H3,(H,58,80)(H,59,73)(H,60,71)(H,61,72)(H,62,77)(H,63,74)(H,64,75)(H,65,81)(H,66,76)(H,67,79)(H,68,78)/t30-,31-,32+,33-,34+,35+,36-,37+,38-,39+,41+,42+/m0/s1
C52H98N16O131155.43391100
95793703

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C52H98N16O13/c1-27(2)11-9-10-12-40(71)59-32(13-19-53)47(76)68-42(31(8)70)52(81)64-35(16-22-56)44(73)63-37-18-24-58-51(80)41(30(7)69)67-48(77)36(17-23-57)61-43(72)33(14-20-54)62-49(78)38(25-28(3)4)66-50(79)39(26-29(5)6)65-45(74)34(15-21-55)60-46(37)75/h12,27-31,58-81H,9-11,13-26,53-57H2,1-8H3/b40-12-,43-33+,44-35-,45-34+,46-37-,47-32+,48-36+,49-38+,50-39+,51-41+,52-42+
C52H98N16O131155.43391100
34018931

11 of 13 defined stereocentres - 11/13 defined
InChI=1/C52H98N16O13/c1-9-29(6)11-10-12-40(71)59-32(13-19-53)47(76)68-42(31(8)70)52(81)64-35(16-22-56)44(73)63-37-18-24-58-51(80)41(30(7)69)67-48(77)36(17-23-57)61-43(72)33(14-20-54)62-49(78)38(25-27(2)3)66-50(79)39(26-28(4)5)65-45(74)34(15-21-55)60-46(37)75/h27-39,41-42,69-70H,9-26,53-57H2,1-8H3,(H,58,80)(H,59,71)(H,60,75)(H,61,72)(H,62,78)(H,63,73)(H,64,81)(H,65,74)(H,66,79)(H,67,77)(H,68,76)/t29?,30-,31-,32+,33+,34+,35+,36+,37+,38+,39-,41?,42+/m1/s1
C52H98N16O131155.43391100
57643382

11 of 12 defined stereocentres - 11/12 defined
InChI=1/C52H98N16O13/c1-27(2)11-9-10-12-40(71)60-33(13-19-53)49(78)68-42(31(8)70)52(81)65-36(16-22-56)46(75)64-38-18-24-58-51(80)41(30(7)69)67-50(79)37(17-23-57)63-45(74)34(14-20-54)61-43(72)32(29(5)6)26-59-44(73)39(25-28(3)4)66-47(76)35(15-21-55)62-48(38)77/h27-39,41-42,69-70H,9-26,53-57H2,1-8H3,(H,58,80)(H,59,73)(H,60,71)(H,61,72)(H,62,77)(H,63,74)(H,64,75)(H,65,81)(H,66,76)(H,67,79)(H,68,78)/t30-,31-,32+,33-,34+,35+,36-,37+,38-,39-,41?,42+/m1/s1
C52H98N16O131155.43391100
12

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