SpectraBase Compound ID | 21wmDOffpLY |
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InChI | InChI=1S/C44H54N4O6/c1-7-27-20-28-21-32(37-30(14-18-47(24-27)25-28)29-12-9-10-13-34(29)45-37)31-22-33-35(23-36(31)52-5)46(4)39-43(33)16-19-48-17-11-15-42(8-2,38(43)48)40(54-26(3)49)44(39,51)41(50)53-6/h9-13,15,21-23,27-28,38-40,45,51H,7-8,14,16-20,24-25H2,1-6H3/b32-21+/t27-,28-,38?,39?,40?,42?,43?,44?/m0/s1 |
InChIKey | UTBKVVAGZAYICA-RVBUWWBYSA-N |
Mol Weight | 734.9 g/mol |
Molecular Formula | C44H54N4O6 |
Exact Mass | 734.404335 g/mol |
SpectraBase Spectrum ID | 1UmXL8ptKzm |
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Name | UTBKVVAGZAYICA-RVBUWWBYSA-N |
Compound Number | 26 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C44H54N4O6 |
InChI | InChI=1S/C44H54N4O6/c1-7-27-20-28-21-32(37-30(14-18-47(24-27)25-28)29-12-9-10-13-34(29)45-37)31-22-33-35(23-36(31)52-5)46(4)39-43(33)16-19-48-17-11-15-42(8-2,38(43)48)40(54-26(3)49)44(39,51)41(50)53-6/h9-13,15,21-23,27-28,38-40,45,51H,7-8,14,16-20,24-25H2,1-6H3/b32-21+/t27-,28-,38?,39?,40?,42?,43?,44?/m0/s1 |
InChIKey | UTBKVVAGZAYICA-RVBUWWBYSA-N |
Literature Reference Author | J.P.KUTNEY,A.HORINAKA,R.S.WARD,B.R.WORTH |
Literature Reference Citation | CAN.J.CHEM.,58,1829(1980) |
Literature Reference DOI | 10.1139/v80-288 |
Molecular Weight | 734.936 g/mol |
Solvent | Unknown |
Source File Reference | UWED3036 |