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Search Hits Limit:
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Isotopically Labeled
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Found 17 results

Search term: MF = 'C_{36}H_{51}N_{5}O_{9}'
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10015431

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C36H51N5O9/c1-21(2)20-50-36(49)41-29(24-9-5-3-6-10-24)33(45)39-27(18-23-15-16-23)32(44)38-26(17-22-13-14-22)31(43)34(46)37-19-28(42)40-30(35(47)48)25-11-7-4-8-12-25/h4,7-8,11-12,21-24,26-27,29-30H,3,5-6,9-10,13-20H2,1-2H3,(H,37,46)(H,38,44)(H,39,45)(H,40,42)(H,41,49)(H,47,48)/t26-,27-,29-,30-/m0/s1
C36H51N5O9697.81824400
71341758

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C36H51N5O9/c1-24(2)33-36(46)38-17-8-12-26-14-15-29(48-4)30(21-26)50-23-31(42)37-16-9-13-27(39-32(43)22-49-19-18-47-3)34(44)40-28(35(45)41-33)20-25-10-6-5-7-11-25/h5-7,10-11,14-15,21,24,27-28,33H,8-9,12-13,16-20,22-23H2,1-4H3,(H,37,42)(H,38,46)(H,39,43)(H,40,44)(H,41,45)/t27-,28-,33+/m0/s1
C36H51N5O9697.81824400
81385070

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C36H51N5O9/c1-21(2)17-31(44)41-16-9-8-15-37-34(45)24-13-14-28(49-7)29(18-24)50-27-12-10-11-26(48-6)25(27)19-38-35(46)32(22(3)4)40-36(47)33(23(5)42)39-30(43)20-41/h10-14,18,21-23,32-33,42H,8-9,15-17,19-20H2,1-7H3,(H,37,45)(H,38,46)(H,39,43)(H,40,47)/t23-,32-,33+/m1/s1
C36H51N5O9697.81823200
430381

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C36H51N5O9/c1-21(2)20-50-36(49)41-29(24-9-5-3-6-10-24)33(45)39-27(18-23-15-16-23)32(44)38-26(17-22-13-14-22)31(43)34(46)37-19-28(42)40-30(35(47)48)25-11-7-4-8-12-25/h4,7-8,11-12,21-24,26-27,29-30H,3,5-6,9-10,13-20H2,1-2H3,(H,37,46)(H,38,44)(H,39,45)(H,40,42)(H,41,49)(H,47,48)
C36H51N5O9697.81823200
23268124

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C36H51N5O9/c1-21(2)20-50-36(49)41-29(24-9-5-3-6-10-24)33(45)39-27(18-23-15-16-23)32(44)38-26(17-22-13-14-22)31(43)34(46)37-19-28(42)40-30(35(47)48)25-11-7-4-8-12-25/h4,7-8,11-12,21-24,26-27,29-30H,3,5-6,9-10,13-20H2,1-2H3,(H,37,46)(H,38,44)(H,39,45)(H,40,42)(H,41,49)(H,47,48)/t26?,27-,29-,30-/m0/s1
C36H51N5O9697.81823300
23268135

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C36H51N5O9/c1-22(2)21-50-36(49)40-30(25-9-5-3-6-10-25)28(42)20-41(19-24-15-16-24)35(48)38-27(17-23-13-14-23)32(44)33(45)37-18-29(43)39-31(34(46)47)26-11-7-4-8-12-26/h4,7-8,11-12,22-25,27,30-31H,3,5-6,9-10,13-21H2,1-2H3,(H,37,45)(H,38,48)(H,39,43)(H,40,49)(H,46,47)/t27?,30-,31-/m0/s1
C36H51N5O9697.81823300
26642541

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C36H51N5O9/c1-7-21(4)32(39-23(6)42)35(48)38-22(5)33(46)41-28(15-20(2)3)30(44)18-31(45)40-29(17-24-11-13-27(43)14-12-24)34(47)37-19-25-9-8-10-26(16-25)36(49)50/h8-14,16,20-22,28-30,32,43-44H,7,15,17-19H2,1-6H3,(H,37,47)(H,38,48)(H,39,42)(H,40,45)(H,41,46)(H,49,50)/t21-,22-,28-,29-,30-,32-/m0/s1
C36H51N5O9697.81823300
8365766

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C36H51N5O9/c1-21(2)20-50-36(49)41-29(24-9-5-3-6-10-24)33(45)39-27(18-23-15-16-23)32(44)38-26(17-22-13-14-22)31(43)34(46)37-19-28(42)40-30(35(47)48)25-11-7-4-8-12-25/h4,7-8,11-12,21-24,26-27,29-30H,3,5-6,9-10,13-20H2,1-2H3,(H,37,46)(H,38,44)(H,39,45)(H,40,42)(H,41,49)(H,47,48)/t26?,27-,29-,30?/m0/s1
C36H51N5O9697.81822100
8660250

1 of 4 defined stereocentres - 1/4 defined
InChI=1/C36H51N5O9/c1-6-47-28(42)16-15-27(33(45)48-7-2)38-31(43)24-13-11-23(12-14-24)25(21-50-29-10-8-9-17-49-29)18-22-19-26-30(37-20-22)39-35(40-32(26)44)41-34(46)36(3,4)5/h11-14,22,25,27,29H,6-10,15-21H2,1-5H3,(H,38,43)(H3,37,39,40,41,44,46)/t22?,25?,27-,29?/m0/s1
C36H51N5O9697.81822100
9094809

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C36H51N5O9/c1-23(2)28(41-35(47)50-36(4,5)6)32(44)40-29(24(3)30(37)42)31(43)38-20-14-13-19-27(33(45)48-21-25-15-9-7-10-16-25)39-34(46)49-22-26-17-11-8-12-18-26/h7-12,15-18,23-24,27-29H,13-14,19-22H2,1-6H3,(H2,37,42)(H,38,43)(H,39,46)(H,40,44)(H,41,47)/t24?,27-,28-,29+/m0/s1
C36H51N5O9697.81822100
23120756

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C36H51N5O9/c1-19(2)23(16-27(42)25(40-34(48)50-36(7,8)9)15-21-18-38-24-14-12-11-13-22(21)24)31(45)39-26(17-28(37)43)32(46)41-29(33(47)49-10)20(3)30(44)35(4,5)6/h11-14,16,18-20,25-26,29,38H,15,17H2,1-10H3,(H2,37,43)(H,39,45)(H,40,48)(H,41,46)/b23-16-/t20?,25-,26-,29-/m0/s1
C36H51N5O9697.81822200
78437981

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C36H51N5O9/c1-3-4-5-6-7-9-27(37)31(44)34(47)38-22(2)35(48)41-19-8-10-30(41)33(46)39-28(20-23-11-15-25(42)16-12-23)32(45)40-29(36(49)50)21-24-13-17-26(43)18-14-24/h11-18,22,27-31,42-44H,3-10,19-21,37H2,1-2H3,(H,38,47)(H,39,46)(H,40,45)(H,49,50)/t22-,27?,28-,29-,30-,31?/m0/s1
C36H51N5O9697.81821100
103253704

Double-bond stereo
InChI=1/C36H51N5O9/c1-36(2,3)50-32(42)15-19-46-21-23-48-25-26-49-24-22-47-20-16-37-33(43)29-11-9-28(10-12-29)27-38-40-34(44)30-13-17-41(18-14-30)35(45)39-31-7-5-4-6-8-31/h4-12,27,30H,13-26H2,1-3H3,(H,37,43)(H,39,45)(H,40,44)/b38-27-
C36H51N5O9697.81821100
34544720

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C36H51N5O9/c1-20-14-23(28(48-7)16-27(20)47-6)25-17-36(50-40-25)18-26(31(43)38-24(15-21-12-13-21)29(42)32(44)37-5)41(19-36)33(45)30(35(2,3)4)39-34(46)49-22-10-8-9-11-22/h14,16,21-22,24,26,30H,8-13,15,17-19H2,1-7H3,(H,37,44)(H,38,43)(H,39,46)/t24-,26-,30+,36+/m0/s1
C36H51N5O9697.81821100
34544809

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C36H51N5O9/c1-20-14-23(15-21(2)29(20)47-6)26-17-36(50-40-26)18-27(31(43)38-25(16-22-12-13-22)28(42)32(44)37-5)41(19-36)33(45)30(35(3,4)48-7)39-34(46)49-24-10-8-9-11-24/h14-15,22,24-25,27,30H,8-13,16-19H2,1-7H3,(H,37,44)(H,38,43)(H,39,46)/t25-,27-,30+,36+/m0/s1
C36H51N5O9697.81821100
34545556

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C36H51N5O9/c1-8-9-25(28(42)32(44)37-23-10-11-23)38-31(43)27-17-36(16-26(40-50-36)22-14-20(2)29(47-7)21(3)15-22)19-41(27)33(45)30(35(4,5)6)39-34(46)49-24-12-13-48-18-24/h14-15,23-25,27,30H,8-13,16-19H2,1-7H3,(H,37,44)(H,38,43)(H,39,46)/t24-,25-,27-,30+,36+/m0/s1
C36H51N5O9697.81821100
34545618

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C36H51N5O9/c1-8-9-25(28(42)32(44)37-23-10-11-23)38-31(43)27-17-36(16-26(40-50-36)22-14-20(2)29(47-7)21(3)15-22)19-41(27)33(45)30(35(4,5)6)39-34(46)49-24-12-13-48-18-24/h14-15,23-25,27,30H,8-13,16-19H2,1-7H3,(H,37,44)(H,38,43)(H,39,46)/t24-,25-,27-,30+,36-/m0/s1
C36H51N5O9697.81821100

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