| SpectraBase Compound ID | A7n3lx6NPli |
|---|---|
| InChI | InChI=1S/C36H58O11/c1-31(2)10-12-35(30(45)47-29-27(43)26(42)25(41)22(16-37)46-29)13-11-33(4)19(20(35)14-31)6-7-23-32(3)15-21(40)28(44)36(17-38,18-39)24(32)8-9-34(23,33)5/h6,20-29,37-44H,7-18H2,1-5H3/t20-,21+,22+,23+,24+,25+,26-,27+,28-,29-,32+,33+,34+,35-/m0/s1 |
| InChIKey | WPWWZJOMLDEMLW-PFYJWDNZSA-N |
| Mol Weight | 666.8 g/mol |
| Molecular Formula | C36H58O11 |
| Exact Mass | 666.397913 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E1vxX3LXyhf |
|---|---|
| Name | BELLERICOSIDE;BETA-D-GLUCOPYRANOSYL-2-ALPHA,3-BETA,23,24-TETRAHYDROXY-OLEAN-12-EN-28-OATE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H58O11 |
| InChI | InChI=1S/C36H58O11/c1-31(2)10-12-35(30(45)47-29-27(43)26(42)25(41)22(16-37)46-29)13-11-33(4)19(20(35)14-31)6-7-23-32(3)15-21(40)28(44)36(17-38,18-39)24(32)8-9-34(23,33)5/h6,20-29,37-44H,7-18H2,1-5H3/t20-,21+,22+,23+,24+,25+,26-,27+,28-,29-,32+,33+,34+,35-/m0/s1 |
| InChIKey | WPWWZJOMLDEMLW-PFYJWDNZSA-N |
| Literature Reference Author | E.BISOLI,W.S.GARCEZ,L.HAMERSKI,C.TIEPPO,F.R.GARCEZ |
| Literature Reference Citation | MOLECULES,13,2717(2008) |
| Literature Reference DOI | 10.3390/molecules13112717 |
| Molecular Weight | 666.850 g/mol |
| Sample ID | 56823 |
| Solvent | C5D5N |