| SpectraBase Compound ID | 1OJzORJvngW |
|---|---|
| InChI | InChI=1S/C37H60O8/c1-20-12-17-37(31(41)43-9)19-18-34(6)22(29(37)36(20,8)42)10-11-24-33(5)15-14-25(32(3,4)23(33)13-16-35(24,34)7)45-30-28(40)27(39)26(38)21(2)44-30/h10,20-21,23-30,38-40,42H,11-19H2,1-9H3/t20-,21-,23?,24?,25-,26-,27+,28+,29?,30-,33-,34+,35+,36+,37-/m0/s1 |
| InChIKey | AGSLVLKVBVWCQR-DRZPPQCESA-N |
| Mol Weight | 632.9 g/mol |
| Molecular Formula | C37H60O8 |
| Exact Mass | 632.428819 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3lZU2ZQwzde |
|---|---|
| Name | METHYL_KALAATE;METHYL_3-BETA-O-ALPHA-L-RHAMNOPYRANOSYL_19-ALPHA-HYDROXY-URS-12-EN-28-OATE |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H60O8 |
| InChI | InChI=1S/C37H60O8/c1-20-12-17-37(31(41)43-9)19-18-34(6)22(29(37)36(20,8)42)10-11-24-33(5)15-14-25(32(3,4)23(33)13-16-35(24,34)7)45-30-28(40)27(39)26(38)21(2)44-30/h10,20-21,23-30,38-40,42H,11-19H2,1-9H3/t20-,21-,23?,24?,25-,26-,27+,28+,29?,30-,33-,34+,35+,36+,37-/m0/s1 |
| InChIKey | AGSLVLKVBVWCQR-DRZPPQCESA-N |
| Literature Reference Author | D.LONTSI,B.L.SONDENGAM,B.BODO,M.T.MARTIN |
| Literature Reference Citation | PLANTA.MED.,64,189(1998) |
| Literature Reference DOI | 10.1055/s-2006-957404 |
| Molecular Weight | 632.879 g/mol |
| Solvent | Unknown |
| Source File Reference | UIAP1116 |