| SpectraBase Compound ID | ERubQFyeXY5 |
|---|---|
| InChI | InChI=1S/C37H57NO8/c1-22-12-17-37(31(42)38-20-29(41)44-9)19-18-34(6)25(30(37)36(22,8)43)10-11-27-32(4)15-14-28(46-24(3)40)33(5,21-45-23(2)39)26(32)13-16-35(27,34)7/h10,22,26-28,30,43H,11-21H2,1-9H3,(H,38,42)/t22-,26-,27-,28+,30-,32+,33+,34-,35-,36-,37+/m1/s1 |
| InChIKey | SINCYPDEZRKEPG-HCBQMTPRSA-N |
| Mol Weight | 643.9 g/mol |
| Molecular Formula | C37H57NO8 |
| Exact Mass | 643.408418 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4ftwJEaVtKl |
|---|---|
| Name | METHYL-N-(3-BETA,23-DIACETOXY-19-ALPHA-HYDROXY-URS-12-EN-28-OYL)-2-AMINO-ACETATE |
| Compound Number | 4A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H57NO8 |
| InChI | InChI=1S/C37H57NO8/c1-22-12-17-37(31(42)38-20-29(41)44-9)19-18-34(6)25(30(37)36(22,8)43)10-11-27-32(4)15-14-28(46-24(3)40)33(5,21-45-23(2)39)26(32)13-16-35(27,34)7/h10,22,26-28,30,43H,11-21H2,1-9H3,(H,38,42)/t22-,26-,27-,28+,30-,32+,33+,34-,35-,36-,37+/m1/s1 |
| InChIKey | SINCYPDEZRKEPG-HCBQMTPRSA-N |
| Literature Reference Author | Y.F.HE,M.L.NAN,J.M.SUN,Z.J.MENG,F.G.YUE,Q.C.ZHAO,X.H.YANG,H. WANG |
| Literature Reference Citation | MOLECULES,17,1278(2012) |
| Literature Reference DOI | 10.3390/molecules17021278 |
| Molecular Weight | 643.861 g/mol |
| Sample ID | 73098 |
| Solvent | C5D5N |