| SpectraBase Compound ID | AdPAUwVPi5i |
|---|---|
| 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-FAFOXJKMSA-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 | 9I8NUY777oQ |
|---|---|
| Name | Methyl-2.alpha.,3.alpha.,24-triacetoxy-urs-12-ene-28-oate |
| Comments | APT, DEPT, INE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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-FAFOXJKMSA-N |
| Instrument Name | SF = 400 MHz |
| Literature Reference | Phytochem. 26, 1107 (1987). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |