| SpectraBase Compound ID | KGU7OJj4ugV |
|---|---|
| InChI | InChI=1S/C32H48O12/c1-16-6-9-21-31(3,19(16)8-7-18-10-13-40-15-18)11-5-12-32(21,4)30(39)44-29-27(25(37)23(35)20(14-33)42-29)43-28-26(38)24(36)22(34)17(2)41-28/h10,13,15,17,20-29,33-38H,5-9,11-12,14H2,1-4H3/t17-,20+,21?,22-,23+,24+,25-,26+,27+,28-,29-,31-,32+/m1/s1 |
| InChIKey | BQWRFUXUUCKOMZ-CZQQVOEUSA-N |
| Mol Weight | 624.7 g/mol |
| Molecular Formula | C32H48O12 |
| Exact Mass | 624.314577 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4BkAzvIjdOw |
|---|---|
| Name | PHLOMISOSIDE-IV;15,16-EPOXY-8,13(16),14-LABDATRIEN-19-OIC-ACID-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYLESTER |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H48O12 |
| InChI | InChI=1S/C32H48O12/c1-16-6-9-21-31(3,19(16)8-7-18-10-13-40-15-18)11-5-12-32(21,4)30(39)44-29-27(25(37)23(35)20(14-33)42-29)43-28-26(38)24(36)22(34)17(2)41-28/h10,13,15,17,20-29,33-38H,5-9,11-12,14H2,1-4H3/t17-,20+,21?,22-,23+,24+,25-,26+,27+,28-,29-,31-,32+/m1/s1 |
| InChIKey | BQWRFUXUUCKOMZ-CZQQVOEUSA-N |
| Literature Reference Author | M.KATAGIRI,K.OHTANI,R.KASAI,K.YAMASAKI,C.R.YANG,O.TANAKA |
| Literature Reference Citation | PHYTOCHEM.,35,439(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)94777-0 |
| Molecular Weight | 624.726 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWSI21286 |