| SpectraBase Compound ID | 8M4390g8nHd |
|---|---|
| InChI | InChI=1S/C78H100N5O28PSi.C6H15N/c1-44(84)79-60-68(99-48(5)88)64(56(40-94-38-51-24-16-12-17-25-51)101-74(60)96-37-36-50-32-34-55(35-33-50)83(90)91)107-75-62(81-46(3)86)70(66-58(102-75)42-97-72(105-66)53-28-20-14-21-29-53)109-112(92,93)110-77-61(80-45(2)85)69(100-49(6)89)65(57(104-77)41-95-39-52-26-18-13-19-27-52)108-76-63(82-47(4)87)71(111-113(10,11)78(7,8)9)67-59(103-76)43-98-73(106-67)54-30-22-15-23-31-54;1-4-7(5-2)6-3/h12-35,56-77H,36-43H2,1-11H3,(H,79,84)(H,80,85)(H,81,86)(H,82,87)(H,92,93);4-6H2,1-3H3/t56-,57+,58-,59-,60-,61+,62-,63-,64+,65-,66+,67+,68-,69+,70-,71-,72+,73+,74+,75+,76+,77+;/m1./s1 |
| InChIKey | BEFAMNBFPHEQEK-GPJRZUJHSA-N |
| Mol Weight | 1715.9 g/mol |
| Molecular Formula | C84H115N6O28PSi |
| Exact Mass | 1714.726621 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FxVJdBDnxh3 |
|---|---|
| Name | #28;2-(4-NITROPHENYL)-ETHYL-2-ACETAMIDO-4,6-O-BENZYLIDENE-3-O-(TERT.-BUTYLDIMETHYLSILYL)-2-DEOXY-BETA-D-GALACTOPYRANOSYL-(1->4)-2-ACETAMIDO-3-O-ACETYL-6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C84H115N6O28PSi |
| InChI | InChI=1S/C78H100N5O28PSi.C6H15N/c1-44(84)79-60-68(99-48(5)88)64(56(40-94-38-51-24-16-12-17-25-51)101-74(60)96-37-36-50-32-34-55(35-33-50)83(90)91)107-75-62(81-46(3)86)70(66-58(102-75)42-97-72(105-66)53-28-20-14-21-29-53)109-112(92,93)110-77-61(80-45(2)85)69(100-49(6)89)65(57(104-77)41-95-39-52-26-18-13-19-27-52)108-76-63(82-47(4)87)71(111-113(10,11)78(7,8)9)67-59(103-76)43-98-73(106-67)54-30-22-15-23-31-54;1-4-7(5-2)6-3/h12-35,56-77H,36-43H2,1-11H3,(H,79,84)(H,80,85)(H,81,86)(H,82,87)(H,92,93);4-6H2,1-3H3/t56-,57+,58-,59-,60-,61+,62-,63-,64+,65-,66+,67+,68-,69+,70-,71-,72+,73+,74+,75+,76+,77+;/m1./s1 |
| InChIKey | BEFAMNBFPHEQEK-GPJRZUJHSA-N |
| Literature Reference Author | J.HANSSON,P.J.GAREGG,S.OSCARSON |
| Literature Reference Citation | J.ORG.CHEM.,66,6234(2001) |
| Literature Reference DOI | 10.1021/jo001302m |
| Molecular Weight | 1715.920 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN24574 |