| SpectraBase Compound ID | 1ALGmNtCzYb |
|---|---|
| InChI | InChI=1S/C17H22O12/c1-26-13(23)7-5-27-14(6-2-3-9(19)17(6,7)16(24)25)29-15-12(22)11(21)10(20)8(4-18)28-15/h5-6,8,10-12,14-15,18,20-22H,2-4H2,1H3,(H,24,25)/t6-,8-,10-,11+,12-,14-,15+,17+/m0/s1 |
| InChIKey | XJRFLCMOTHIFMB-OPQOLILRSA-N |
| Mol Weight | 418.35 g/mol |
| Molecular Formula | C17H22O12 |
| Exact Mass | 418.111126 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4MeKCe4Etc7 |
|---|---|
| Name | 10-GRISELINOSIDIC-ACID |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C17H22O12 |
| InChI | InChI=1S/C17H22O12/c1-26-13(23)7-5-27-14(6-2-3-9(19)17(6,7)16(24)25)29-15-12(22)11(21)10(20)8(4-18)28-15/h5-6,8,10-12,14-15,18,20-22H,2-4H2,1H3,(H,24,25)/t6-,8-,10-,11+,12-,14-,15+,17+/m0/s1 |
| InChIKey | XJRFLCMOTHIFMB-OPQOLILRSA-N |
| Literature Reference Author | T.A.FEDERARO,F.R.STERMITZ |
| Literature Reference Citation | PHYTOCHEM.,31,4191(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)80441-G |
| Molecular Weight | 418.354 g/mol |
| Solvent | D2O |
| Source File Reference | UWMS27854 |