| SpectraBase Compound ID | DiFx2CempH3 |
|---|---|
| InChI | InChI=1S/C30H42O9/c1-15-24(33)25(34)26(35)27(38-15)39-18-8-10-28(2)17(12-18)5-6-20-19(28)9-11-29(3)23(21(31)13-30(20,29)36)16-4-7-22(32)37-14-16/h4,7,12,14-15,18-21,23-27,31,33-36H,5-6,8-11,13H2,1-3H3/t15-,18-,19-,20+,21-,23?,24-,25+,26+,27-,28-,29+,30-/m0/s1 |
| InChIKey | FIPZUWCZGCGMNN-RCWFNEAXSA-N |
| Mol Weight | 546.7 g/mol |
| Molecular Formula | C30H42O9 |
| Exact Mass | 546.282883 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LjgjfKvmdtF |
|---|---|
| Name | 16-BETA-HYDROXY-PROSCILLARIDIN-A;16-BETA-HYDROXY-SCILLARENIN-3-O-ALPHA-L-RHAMNOSIDE |
| Compound Number | 17 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H42O9 |
| InChI | InChI=1S/C30H42O9/c1-15-24(33)25(34)26(35)27(38-15)39-18-8-10-28(2)17(12-18)5-6-20-19(28)9-11-29(3)23(21(31)13-30(20,29)36)16-4-7-22(32)37-14-16/h4,7,12,14-15,18-21,23-27,31,33-36H,5-6,8-11,13H2,1-3H3/t15-,18-,19-,20+,21-,23?,24-,25+,26+,27-,28-,29+,30-/m0/s1 |
| InChIKey | FIPZUWCZGCGMNN-RCWFNEAXSA-N |
| Literature Reference Author | B.KOPP,L.KRENN,M.DRAXLER,A.HOYER,R.TERKOLA,P.VALLASTER,W.ROB IEN |
| Literature Reference Citation | PHYTOCHEM.,42,513(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00876-4 |
| Molecular Weight | 546.658 g/mol |
| Solvent | CDCl3:CD3OD=1:1 |
| Source File Reference | UWLU3385 |