| SpectraBase Compound ID | Xaw6xJFmJq |
|---|---|
| InChI | InChI=1S/C36H58O8/c1-19(2)20(3)9-10-21(31(41)42)22-11-16-36(8)28-23(12-15-35(22,36)7)34(6)14-13-27(38)33(4,5)26(34)17-25(28)44-32-30(40)29(39)24(37)18-43-32/h19,21-22,24-27,29-30,32,37-40H,3,9-18H2,1-2,4-8H3,(H,41,42)/t21-,22+,24+,25+,26-,27-,29-,30+,32-,34+,35+,36-/m0/s1 |
| InChIKey | HDOFFHWEALRKKU-HRVFTWSMSA-N |
| Mol Weight | 618.9 g/mol |
| Molecular Formula | C36H58O8 |
| Exact Mass | 618.413169 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6UoP1gHgqED |
|---|---|
| Name | LAETIPOSIDE-E;3-BETA,7-ALPHA-DIHYDROXY-24-METHYLENE-LANOST-8-EN-21-OIC-ACID-7-O-BETA-D-XYLOPYRANOSIDE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H58O8 |
| InChI | InChI=1S/C36H58O8/c1-19(2)20(3)9-10-21(31(41)42)22-11-16-36(8)28-23(12-15-35(22,36)7)34(6)14-13-27(38)33(4,5)26(34)17-25(28)44-32-30(40)29(39)24(37)18-43-32/h19,21-22,24-27,29-30,32,37-40H,3,9-18H2,1-2,4-8H3,(H,41,42)/t21-,22+,24+,25+,26-,27-,29-,30+,32-,34+,35+,36-/m0/s1 |
| InChIKey | HDOFFHWEALRKKU-HRVFTWSMSA-N |
| Literature Reference Author | K.YOSHIKAWA,K.MATSUMOTO,C.MINE,S.BANDO,S.ARIHARA |
| Literature Reference Citation | CHEM.PHARM.BULL.,48,1418(2000) |
| Literature Reference DOI | 10.1248/cpb.48.1418 |
| Molecular Weight | 618.852 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN4572 |