| SpectraBase Compound ID | 3K36X9X8uwg |
|---|---|
| InChI | InChI=1S/C32H44O12/c1-16(34)42-20-13-32(40)30(3,24(20)17-4-5-23(35)41-15-17)10-8-22-29(2)9-7-19(12-18(29)6-11-31(22,32)39)43-28-27(38)26(37)25(36)21(14-33)44-28/h4-5,12,15,19-22,24-28,33,36-40H,6-11,13-14H2,1-3H3/t19-,20-,21+,22+,24?,25+,26-,27+,28+,29-,30+,31-,32+/m0/s1 |
| InChIKey | IEIPZMSLLOZXOG-AGJPUFLRSA-N |
| Mol Weight | 620.7 g/mol |
| Molecular Formula | C32H44O12 |
| Exact Mass | 620.283277 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | CQM0KJrDwRn |
|---|---|
| Name | 16-BETA-O-ACETYL-SCILLIRUBROSIDE |
| Compound Number | 25 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H44O12 |
| InChI | InChI=1S/C32H44O12/c1-16(34)42-20-13-32(40)30(3,24(20)17-4-5-23(35)41-15-17)10-8-22-29(2)9-7-19(12-18(29)6-11-31(22,32)39)43-28-27(38)26(37)25(36)21(14-33)44-28/h4-5,12,15,19-22,24-28,33,36-40H,6-11,13-14H2,1-3H3/t19-,20-,21+,22+,24?,25+,26-,27+,28+,29-,30+,31-,32+/m0/s1 |
| InChIKey | IEIPZMSLLOZXOG-AGJPUFLRSA-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 | 620.694 g/mol |
| Solvent | CDCl3:CD3OD=1:1 |
| Source File Reference | UWLU3392 |