| SpectraBase Compound ID | 4glIrJnj3a8 |
|---|---|
| InChI | InChI=1S/C71H121NO23/c1-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-32-35-38-41-44-60(87-50(5)74)69(82)72-58(63(89-52(7)76)59(86-49(4)73)43-40-37-34-31-29-28-30-33-36-39-42-48(2)3)45-83-71-68(94-57(12)81)66(92-55(10)79)64(90-53(8)77)62(95-71)47-85-70-67(93-56(11)80)65(91-54(9)78)61(46-84-70)88-51(6)75/h48,58-68,70-71H,13-47H2,1-12H3,(H,72,82)/t58-,59+,60-,61+,62-,63-,64-,65+,66+,67-,68-,70-,71-/m1/s1 |
| InChIKey | BAWOMBIKWTWVLA-JEMMTPKUSA-N |
| Mol Weight | 1356.7 g/mol |
| Molecular Formula | C71H121NO23 |
| Exact Mass | 1355.832939 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AjYZQtaGlWY |
|---|---|
| Name | VESPARIOSIDE-PERACETYLATED |
| Compound Number | 1B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C71H121NO23 |
| InChI | InChI=1S/C71H121NO23/c1-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-32-35-38-41-44-60(87-50(5)74)69(82)72-58(63(89-52(7)76)59(86-49(4)73)43-40-37-34-31-29-28-30-33-36-39-42-48(2)3)45-83-71-68(94-57(12)81)66(92-55(10)79)64(90-53(8)77)62(95-71)47-85-70-67(93-56(11)80)65(91-54(9)78)61(46-84-70)88-51(6)75/h48,58-68,70-71H,13-47H2,1-12H3,(H,72,82)/t58-,59+,60-,61+,62-,63-,64-,65+,66+,67-,68-,70-,71-/m1/s1 |
| InChIKey | BAWOMBIKWTWVLA-JEMMTPKUSA-N |
| Literature Reference Author | V.COSTANTIO,E.FATTORUSSO,C.IMPERATORE,A.MANGONI |
| Literature Reference Citation | EUR.J.ORG.CHEM.,368(2005) |
| Literature Reference DOI | 10.1002/ejoc.200400543 |
| Molecular Weight | 1356.735 g/mol |
| Sample ID | 46646 |
| Solvent | CDCl3 |