| SpectraBase Compound ID | I0RrOaT1KAY |
|---|---|
| InChI | InChI=1S/C35H56O9/c1-30(2)13-14-35(29(41)42)20(15-30)19-7-8-23-31(3)11-10-25(44-28-27(40)26(39)21(37)17-43-28)32(4,18-36)22(31)9-12-33(23,5)34(19,6)16-24(35)38/h7,20-28,36-40H,8-18H2,1-6H3,(H,41,42)/t20?,21-,22?,23?,24+,25-,26-,27+,28-,31-,32-,33+,34+,35+/m0/s1 |
| InChIKey | FCPRBNDLDDAHLC-IJRDZWOMSA-N |
| Mol Weight | 620.8 g/mol |
| Molecular Formula | C35H56O9 |
| Exact Mass | 620.392433 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IoGQSmQOqMK |
|---|---|
| Name | 3-O-ALPHA-L-ARABINOPYRANOSYL-CAULOPHYLLOGENIN |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H56O9 |
| InChI | InChI=1S/C35H56O9/c1-30(2)13-14-35(29(41)42)20(15-30)19-7-8-23-31(3)11-10-25(44-28-27(40)26(39)21(37)17-43-28)32(4,18-36)22(31)9-12-33(23,5)34(19,6)16-24(35)38/h7,20-28,36-40H,8-18H2,1-6H3,(H,41,42)/t20?,21-,22?,23?,24+,25-,26-,27+,28-,31-,32-,33+,34+,35+/m0/s1 |
| InChIKey | FCPRBNDLDDAHLC-IJRDZWOMSA-N |
| Literature Reference Author | M.CHEN,W.W.WU,D.NANZ,O.STICHER |
| Literature Reference Citation | PHYTOCHEM.,44,497(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(96)00546-8 |
| Molecular Weight | 620.824 g/mol |
| Solvent | C5D5N:CD3OD |
| Source File Reference | UWPA146 |