| SpectraBase Compound ID | BSlijStv6N1 |
|---|---|
| InChI | InChI=1S/C49H80O18/c1-24-41(52)31(56-8)19-38(60-24)65-43-26(3)62-40(21-33(43)58-10)67-44-27(4)63-39(22-34(44)59-11)66-42-25(2)61-37(20-32(42)57-9)64-30-13-14-45(6)29(18-30)12-15-48(54)35(45)23-36(51)46(7)47(53,28(5)50)16-17-49(46,48)55/h12,24-27,30-44,51-55H,13-23H2,1-11H3/t24-,25+,26+,27+,30-,31+,32-,33-,34+,35+,36+,37-,38+,39+,40-,41-,42+,43+,44-,45-,46+,47+,48-,49+/m0/s1 |
| InChIKey | QRIXVSZPQJPPAL-DECHHFKTSA-N |
| Mol Weight | 957.2 g/mol |
| Molecular Formula | C49H80O18 |
| Exact Mass | 956.534466 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 | 6Y0A5girCZI |
|---|---|
| Name | DEACYLMETAPLEXIGENIN-3-O-ALPHA-L-CYMAROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-ALPHA-L-DIGINOPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H80O18 |
| InChI | InChI=1S/C49H80O18/c1-24-41(52)31(56-8)19-38(60-24)65-43-26(3)62-40(21-33(43)58-10)67-44-27(4)63-39(22-34(44)59-11)66-42-25(2)61-37(20-32(42)57-9)64-30-13-14-45(6)29(18-30)12-15-48(54)35(45)23-36(51)46(7)47(53,28(5)50)16-17-49(46,48)55/h12,24-27,30-44,51-55H,13-23H2,1-11H3/t24-,25+,26+,27+,30-,31+,32-,33-,34+,35+,36+,37-,38+,39+,40-,41-,42+,43+,44-,45-,46+,47+,48-,49+/m0/s1 |
| InChIKey | QRIXVSZPQJPPAL-DECHHFKTSA-N |
| Literature Reference Author | S.TSUKAMOTO,K.HAYASHI,H.MITSUHASHI |
| Literature Reference Citation | CHEM.PHARM.BULL.,33,2294(1985) |
| Literature Reference DOI | 10.1248/cpb.33.2294 |
| Molecular Weight | 957.163 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBK1247 |