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Search Hits Limit:
Single/Multi-component
Isotopically Labeled
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Found 16 results

Search term: MF = 'C_{40}H_{54}N_{4}O_{10}S'
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17339576
InChI=1/2C20H24N2O2.H2O4S.2H2O/c2*1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;1-5(2,3)4;;/h2*3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H2,1,2,3,4);2*1H2/t2*13-,14-,19-,20+;;;/m00.../s1
C40H54N4O10S782.9426233100
571129
InChI=1/2C20H24N2O2.H2O4S.2H2O/c2*1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;1-5(2,3)4;;/h2*3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H2,1,2,3,4);2*1H2/t2*13-,14-,19+,20-;;;/m00.../s1
C40H54N4O10S782.9426171500
55298
InChI=1/2C20H24N2O2.H2O4S.2H2O/c2*1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;1-5(2,3)4;;/h2*3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H2,1,2,3,4);2*1H2/t2*13-,14?,19-,20+;;;/m00.../s1
C40H54N4O10S782.94256119422
58195
InChI=1/2C20H24N2O2.H2O4S.2H2O/c2*1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;1-5(2,3)4;;/h2*3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H2,1,2,3,4);2*1H2/t2*13-,14?,19+,20-;;;/m00.../s1
C40H54N4O10S782.9425611700
571126
InChI=1/2C20H24N2O2.H2O4S.2H2O/c2*1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;1-5(2,3)4;;/h2*3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H2,1,2,3,4);2*1H2/t2*13-,14+,19-,20+;;;/m00.../s1
C40H54N4O10S782.9425599999989400
17347235
InChI=1/2C20H24N2O2.H2O4S.2H2O/c2*1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;1-5(2,3)4;;/h2*3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H2,1,2,3,4);2*1H2/t2*13-,14?,19-,20+;;;/m11.../s1
C40H54N4O10S782.94264600
2743385

Double-bond stereo

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C40H54N4O10S/c1-6-22-52-40-36(44(4)55(49,50)30-17-14-28(15-18-30)42-26(3)47)25-34(43-51-5)32-23-27(12-8-10-20-45)31(13-9-11-21-46)37(38(32)40)33-24-29(16-19-35(33)54-40)53-39(48)41-7-2/h6,14-19,23-24,27,31,36-38,45-46H,1,7-13,20-22,25H2,2-5H3,(H,41,48)(H,42,47)
C40H54N4O10S782.9425599999982100
5063951

Double-bond stereo

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C40H54N4O10S/c1-6-22-52-40-36(44(4)55(49,50)30-17-14-28(15-18-30)42-26(3)47)25-34(43-51-5)32-23-27(12-8-10-20-45)31(13-9-11-21-46)37(38(32)40)33-24-29(16-19-35(33)54-40)53-39(48)41-7-2/h6,14-19,23-24,27,31,36-38,45-46H,1,7-13,20-22,25H2,2-5H3,(H,41,48)(H,42,47)/t27-,31+,36-,37+,38+,40+/m0/s1
C40H54N4O10S782.94262100
9609107

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C40H54N4O10S/c1-7-20-52-38-28(24-34(46)42-33(22-26-11-9-8-10-12-26)36(48)43-31(19-21-55-6)37(49)51-5)15-18-30(53-38)25-41-35(47)32(44-39(50)54-40(2,3)4)23-27-13-16-29(45)17-14-27/h7-18,28,30-33,38,45H,1,19-25H2,2-6H3,(H,41,47)(H,42,46)(H,43,48)(H,44,50)/t28-,30+,31+,32+,33+,38+/m1/s1
C40H54N4O10S782.94262100
21242004
InChI=1/2C20H24N2O2.H2O4S.2H2O/c2*1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;1-5(2,3)4;;/h2*3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H2,1,2,3,4);2*1H2/t2*13?,14?,19?,20-;;;/m10.../s1
C40H54N4O10S782.94261100
57643305
InChI=1/2C20H24N2O2.H2O4S.2H2O/c2*1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;1-5(2,3)4;;/h2*3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H2,1,2,3,4);2*1H2/t2*13-,14?,19?,20-;;;/m00.../s1
C40H54N4O10S782.94261100
57643307
InChI=1/2C20H24N2O2.H2O4S.2H2O/c2*1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;1-5(2,3)4;;/h2*3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H2,1,2,3,4);2*1H2/t2*13-,14?,19?,20+;;;/m00.../s1
C40H54N4O10S782.94261100
78430412
InChI=1/2C20H24N2O2.H2O4S.2H2O/c2*1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;1-5(2,3)4;;/h2*3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H2,1,2,3,4);2*1H2/t2*13-,14-,19-,20-;;;/m00.../s1
C40H54N4O10S782.94261100

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