| SpectraBase Compound ID | 4Lz2wE4bw89 |
|---|---|
| InChI | InChI=1S/C88H167NO14Si5/c1-36-42-72(52-65(17)51-66(18)53-79(95-30)83(102-105(34,35)88(25,26)27)80(96-31)55-68(20)82(103-106(37-2,38-3)39-4)84(85(90)91)97-58-70-44-47-73(93-28)48-45-70)77(99-104(32,33)87(22,23)24)57-76(101-108(62(11)12,63(13)14)64(15)16)69(21)81(98-86(92)74-43-40-41-50-89-74)67(19)54-71-46-49-75(78(56-71)94-29)100-107(59(5)6,60(7)8)61(9)10/h36,44-45,47-48,52,54,59-64,66,68-69,71-72,74-84,89H,1,37-43,46,49-51,53,55-58H2,2-35H3,(H,90,91)/b65-52+,67-54+/t66-,68+,69-,71+,72+,74+,75-,76-,77+,78-,79-,80-,81-,82+,83+,84?/m1/s1 |
| InChIKey | UUYZFAKBSSFXKB-GBLRQGMASA-N |
| Mol Weight | 1603.7 g/mol |
| Molecular Formula | C88H167NO14Si5 |
| Exact Mass | 1602.123292 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F5D0zzTnwP3 |
|---|---|
| Name | UUYZFAKBSSFXKB-GBLRQGMASA-N |
| Compound Number | 85 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C88H167NO14Si5 |
| InChI | InChI=1S/C88H167NO14Si5/c1-36-42-72(52-65(17)51-66(18)53-79(95-30)83(102-105(34,35)88(25,26)27)80(96-31)55-68(20)82(103-106(37-2,38-3)39-4)84(85(90)91)97-58-70-44-47-73(93-28)48-45-70)77(99-104(32,33)87(22,23)24)57-76(101-108(62(11)12,63(13)14)64(15)16)69(21)81(98-86(92)74-43-40-41-50-89-74)67(19)54-71-46-49-75(78(56-71)94-29)100-107(59(5)6,60(7)8)61(9)10/h36,44-45,47-48,52,54,59-64,66,68-69,71-72,74-84,89H,1,37-43,46,49-51,53,55-58H2,2-35H3,(H,90,91)/b65-52+,67-54+/t66-,68+,69-,71+,72+,74+,75-,76-,77+,78-,79-,80-,81-,82+,83+,84?/m1/s1 |
| InChIKey | UUYZFAKBSSFXKB-GBLRQGMASA-N |
| Literature Reference Author | T.K.JONES,R.A.REAMER,R.DESMOND,S.G.MILLS |
| Literature Reference Citation | J.AM.CHEM.SOC.,112,2998(1990) |
| Literature Reference DOI | 10.1021/ja00164a023 |
| Molecular Weight | 1603.720 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU6584 |