![BENZYL-[4-NITROPHENYL-2-[(ETOPOSIDE-4'-O-CARBONYL)-METHYLAMINO]-2,3,4-TRI-O-(TERT.-BUTYLDIMETHYLSILYL)-BETA-D-GLUCOPYRANOSID]-URONATE](/api/spectrum/GZyUlsrOT21/structure.png?h=300&w=458 "BENZYL-[4-NITROPHENYL-2-[(ETOPOSIDE-4'-O-CARBONYL)-METHYLAMINO]-2,3,4-TRI-O-(TERT.-BUTYLDIMETHYLSILYL)-BETA-D-GLUCOPYRANOSID]-URONATE")
| SpectraBase Compound ID | LN62r30AU9l |
|---|---|
| InChI | InChI=1S/C68H94N2O23Si3/c1-36-80-34-49-56(85-36)52(71)53(72)63(87-49)88-54-41-31-46-45(83-35-84-46)30-40(41)50(51-42(54)33-82-61(51)73)38-27-47(78-12)55(48(28-38)79-13)90-65(75)69(11)43-29-39(70(76)77)25-26-44(43)86-64-60(93-96(18,19)68(8,9)10)58(92-95(16,17)67(5,6)7)57(91-94(14,15)66(2,3)4)59(89-64)62(74)81-32-37-23-21-20-22-24-37/h20-31,36,42,49-54,56-60,63-64,71-72H,32-35H2,1-19H3/t36-,42+,49-,50-,51+,52-,53-,54-,56-,57-,58-,59-,60+,63+,64+/m0/s1 |
| InChIKey | JBIAAUZJCIRVAX-GMTAAUKWSA-N |
| Mol Weight | 1391.7 g/mol |
| Molecular Formula | C68H94N2O23Si3 |
| Exact Mass | 1390.555517 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GZyUlsrOT21 |
|---|---|
| Name | BENZYL-[4-NITROPHENYL-2-[(ETOPOSIDE-4'-O-CARBONYL)-METHYLAMINO]-2,3,4-TRI-O-(TERT.-BUTYLDIMETHYLSILYL)-BETA-D-GLUCOPYRANOSID]-URONATE |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C68H94N2O23Si3 |
| InChI | InChI=1S/C68H94N2O23Si3/c1-36-80-34-49-56(85-36)52(71)53(72)63(87-49)88-54-41-31-46-45(83-35-84-46)30-40(41)50(51-42(54)33-82-61(51)73)38-27-47(78-12)55(48(28-38)79-13)90-65(75)69(11)43-29-39(70(76)77)25-26-44(43)86-64-60(93-96(18,19)68(8,9)10)58(92-95(16,17)67(5,6)7)57(91-94(14,15)66(2,3)4)59(89-64)62(74)81-32-37-23-21-20-22-24-37/h20-31,36,42,49-54,56-60,63-64,71-72H,32-35H2,1-19H3/t36-,42+,49-,50-,51+,52-,53-,54-,56-,57-,58-,59-,60+,63+,64+/m0/s1 |
| InChIKey | JBIAAUZJCIRVAX-GMTAAUKWSA-N |
| Literature Reference Author | F.SCHMIDT,C.MONNERET |
| Literature Reference Citation | BIOORG.MED.CHEM.,11,2277(2003) |
| Literature Reference DOI | 10.1016/S0968-0896(03)00108-1 |
| Molecular Weight | 1391.750 g/mol |
| Sample ID | 29303 |
| Solvent | CDCl3 |