| SpectraBase Compound ID | HxNj8kzITii |
|---|---|
| InChI | InChI=1S/C36H56O9/c1-30(2)12-14-35-15-13-34(7)33(6)11-8-19-31(3,4)21(43-28-24(40)23(39)22(38)18(17-37)42-28)9-10-32(19,5)26(33)25-27(44-25)36(34,20(35)16-30)45-29(35)41/h18-28,37-40H,8-17H2,1-7H3/t18-,19+,20-,21+,22-,23+,24-,25+,26-,27+,28+,32+,33-,34+,35+,36-/m1/s1 |
| InChIKey | QRMSXTGFODLIKM-QTGSPITBSA-N |
| Mol Weight | 632.8 g/mol |
| Molecular Formula | C36H56O9 |
| Exact Mass | 632.392433 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IzKA8D1TcBT |
|---|---|
| Name | 3-O-BETA-D-GLUCOPYRANOSY-11-ALPHA,12-ALPHA-EPOXY-OLEAN-28,13-OLIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H56O9 |
| InChI | InChI=1S/C36H56O9/c1-30(2)12-14-35-15-13-34(7)33(6)11-8-19-31(3,4)21(43-28-24(40)23(39)22(38)18(17-37)42-28)9-10-32(19,5)26(33)25-27(44-25)36(34,20(35)16-30)45-29(35)41/h18-28,37-40H,8-17H2,1-7H3/t18-,19+,20-,21+,22-,23+,24-,25+,26-,27+,28+,32+,33-,34+,35+,36-/m1/s1 |
| InChIKey | QRMSXTGFODLIKM-QTGSPITBSA-N |
| Literature Reference Author | M.C.M.YOUNG,A.POTOMATI,E.P.CHU,M.HARAGUCHI,M.YAMAMOTO,T.KAWA NO |
| Literature Reference Citation | PHYTOCHEM.,46,1267(1997) |
| Literature Reference DOI | 10.1016/s0031-9422(97)80024-6 |
| Molecular Weight | 632.835 g/mol |
| Sample ID | 65503 |
| Solvent | C5D5N |