| SpectraBase Compound ID | BEPVBmGdv1c |
|---|---|
| InChI | InChI=1S/C21H36O10/c1-19(2,31-18-17(27)16(26)15(25)13(8-22)30-18)10-4-5-21(29,9-23)12-7-14(24)20(3,28)11(12)6-10/h10-13,15-18,22-23,25-29H,4-9H2,1-3H3/t10-,11-,12+,13+,15+,16-,17+,18-,20+,21+/m1/s1 |
| InChIKey | QNBLVYVBWDIWDM-QNXIMEFYSA-N |
| Mol Weight | 448.5 g/mol |
| Molecular Formula | C21H36O10 |
| Exact Mass | 448.230847 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4iif4oLcAOo |
|---|---|
| Name | ATRACTYLOSIDE-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H36O10 |
| InChI | InChI=1S/C21H36O10/c1-19(2,31-18-17(27)16(26)15(25)13(8-22)30-18)10-4-5-21(29,9-23)12-7-14(24)20(3,28)11(12)6-10/h10-13,15-18,22-23,25-29H,4-9H2,1-3H3/t10-,11-,12+,13+,15+,16-,17+,18-,20+,21+/m1/s1 |
| InChIKey | QNBLVYVBWDIWDM-QNXIMEFYSA-N |
| Literature Reference Author | J.KITAJIMA,A.KAMOSHITA,T.ISHIKAWA,A.TAKANO,T.FUKUDA,S.ISODA, Y.IDA |
| Literature Reference Citation | CHEM.PHARM.BULL.,51,673(2003) |
| Literature Reference DOI | 10.1248/cpb.51.673 |
| Molecular Weight | 448.511 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS21445 |