SpectraBase Compound ID | EpwozjzAkf0 |
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InChI | InChI=1S/C47H70N5O14PS2/c1-30(2)25-34(48)39(55)52-35(26-31-15-13-12-14-16-31)40(56)50-28-37(53)49-29-38(54)51-36(27-32-17-19-33(20-18-32)64-44(60)65-47(9,10)11)41(57)66-67(61,62-21-23-68-42(58)45(3,4)5)63-22-24-69-43(59)46(6,7)8/h12-20,30,34-36H,21-29,48H2,1-11H3,(H,49,53)(H,50,56)(H,51,54)(H,52,55) |
InChIKey | GKKONNLYDLCTOK-UHFFFAOYSA-N |
Mol Weight | 1024.2 g/mol |
Molecular Formula | C47H70N5O14PS2 |
Exact Mass | 1023.409831 g/mol |
SpectraBase Spectrum ID | 9pyySTAAVvU |
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Name | GKKONNLYDLCTOK-UHFFFAOYSA-N |
Compound Number | 4A |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C47H70N5O14PS2 |
InChI | InChI=1S/C47H70N5O14PS2/c1-30(2)25-34(48)39(55)52-35(26-31-15-13-12-14-16-31)40(56)50-28-37(53)49-29-38(54)51-36(27-32-17-19-33(20-18-32)64-44(60)65-47(9,10)11)41(57)66-67(61,62-21-23-68-42(58)45(3,4)5)63-22-24-69-43(59)46(6,7)8/h12-20,30,34-36H,21-29,48H2,1-11H3,(H,49,53)(H,50,56)(H,51,54)(H,52,55) |
InChIKey | GKKONNLYDLCTOK-UHFFFAOYSA-N |
Literature Reference Author | C.MATHE,C.PERIGAUD,G.GOSSELIN,J.L.IMBACH |
Literature Reference Citation | J.ORG.CHEM.,63,8547(1998) |
Literature Reference DOI | 10.1021/jo980437d |
Solvent | DMSO-D6 |
Source File Reference | UWMZ26115 |