| SpectraBase Compound ID | DvNkh6v2h0I |
|---|---|
| InChI | InChI=1S/C36H60O8/c1-21(2)11-10-15-36(8,41)24-13-18-35(7)29(24)26(44-32-31(40)30(39)25(37)20-43-32)19-27-33(5,16-14-28(38)42-9)23(22(3)4)12-17-34(27,35)6/h11,23-27,29-32,37,39-41H,3,10,12-20H2,1-2,4-9H3/t23-,24-,25-,26+,27+,29-,30+,31-,32+,33-,34+,35+,36?/m0/s1 |
| InChIKey | GQEBOLZPLNFXEZ-GSSSDUAISA-N |
| Mol Weight | 620.9 g/mol |
| Molecular Formula | C36H60O8 |
| Exact Mass | 620.428819 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FoVv6Oe6BX7 |
|---|---|
| Name | BETULA-SCHMIDTOSIDE-A;METHYL-(12R,20S)-20-HYDROXY-12-BETA-D-XYLOPYRANOSYLOXY-3,4-SECO-DAMMARA-4(28),24-DIEN-3-OATE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H60O8 |
| InChI | InChI=1S/C36H60O8/c1-21(2)11-10-15-36(8,41)24-13-18-35(7)29(24)26(44-32-31(40)30(39)25(37)20-43-32)19-27-33(5,16-14-28(38)42-9)23(22(3)4)12-17-34(27,35)6/h11,23-27,29-32,37,39-41H,3,10,12-20H2,1-2,4-9H3/t23-,24-,25-,26+,27+,29-,30+,31-,32+,33-,34+,35+,36?/m0/s1 |
| InChIKey | GQEBOLZPLNFXEZ-GSSSDUAISA-N |
| Literature Reference Author | H.FUCHINO,T.SATOH,J.HIDA,M.TERADA,N.TANAKA |
| Literature Reference Citation | CHEM.PHARM.BULL.,46,1051(1998) |
| Literature Reference DOI | 10.1248/cpb.46.1051 |
| Molecular Weight | 620.868 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS6550 |