| SpectraBase Compound ID | GyOMrWJhmXA |
|---|---|
| InChI | InChI=1S/C37H56O8/c1-21-13-16-37(32(41)42-10)18-17-35(8)26(30(37)22(21)2)11-12-29-33(6)19-27(44-24(4)39)31(45-25(5)40)34(7,20-43-23(3)38)28(33)14-15-36(29,35)9/h11,21-22,27-31H,12-20H2,1-10H3/t21-,22+,27-,28-,29-,30+,31-,33+,34+,35-,36-,37+/m1/s1 |
| InChIKey | RBROFYWGBCTLGA-PCAOXRAQSA-N |
| Mol Weight | 628.8 g/mol |
| Molecular Formula | C37H56O8 |
| Exact Mass | 628.397519 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4mtp49d9UTb |
|---|---|
| Name | METHYL-1-ALPHA,2-ALPHA,23-TRIACETOXY-URS-12-EN-28-OATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H56O8 |
| InChI | InChI=1S/C37H56O8/c1-21-13-16-37(32(41)42-10)18-17-35(8)26(30(37)22(21)2)11-12-29-33(6)19-27(44-24(4)39)31(45-25(5)40)34(7,20-43-23(3)38)28(33)14-15-36(29,35)9/h11,21-22,27-31H,12-20H2,1-10H3/t21-,22+,27-,28-,29-,30+,31-,33+,34+,35-,36-,37+/m1/s1 |
| InChIKey | RBROFYWGBCTLGA-PCAOXRAQSA-N |
| Literature Reference Author | M.O.F.GOULART,A.E.G.SANATNA,R.J.ALVES,J.D.D.S.FILHO,J.G.S.MA IA,G.G.D.OLIVEIRA,A. |
| Literature Reference Citation | PHYTOCHEM.,37,1139(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)89544-8 |
| Molecular Weight | 628.847 g/mol |
| Solvent | Unknown |
| Source File Reference | UWLU24052 |