| SpectraBase Compound ID | 5HK8adTDuj6 |
|---|---|
| InChI | InChI=1S/C47H78O17/c1-20-9-14-47(19-49)28(52)16-46(8)23(30(47)21(20)2)15-24(50)39-44(6)12-11-29(43(4,5)27(44)10-13-45(39,46)7)62-41-37(34(56)31(53)22(3)60-41)64-42-38(35(57)33(55)26(17-48)61-42)63-40-36(58)32(54)25(51)18-59-40/h15,20-22,24-42,48-58H,9-14,16-19H2,1-8H3/t20-,21+,22-,24-,25-,26-,27+,28-,29+,30+,31+,32+,33-,34+,35+,36-,37-,38-,39-,40+,41+,42+,44+,45-,46-,47+/m1/s1 |
| InChIKey | DVWGWTHVNBZXHK-FNWIDQPCSA-N |
| Mol Weight | 915.1 g/mol |
| Molecular Formula | C47H78O17 |
| Exact Mass | 914.523901 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 | JFMKDXF2I1u |
|---|---|
| Name | ROTUNDIFOLIOSIDE-B;#10;11-ALPHA,16-ALPHA,28-TRIHYDROXY-URS-12-EN-3-BETA-YL-BETA-D-XYLOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-FUCOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H78O17 |
| InChI | InChI=1S/C47H78O17/c1-20-9-14-47(19-49)28(52)16-46(8)23(30(47)21(20)2)15-24(50)39-44(6)12-11-29(43(4,5)27(44)10-13-45(39,46)7)62-41-37(34(56)31(53)22(3)60-41)64-42-38(35(57)33(55)26(17-48)61-42)63-40-36(58)32(54)25(51)18-59-40/h15,20-22,24-42,48-58H,9-14,16-19H2,1-8H3/t20-,21+,22-,24-,25-,26-,27+,28-,29+,30+,31+,32+,33-,34+,35+,36-,37-,38-,39-,40+,41+,42+,44+,45-,46-,47+/m1/s1 |
| InChIKey | DVWGWTHVNBZXHK-FNWIDQPCSA-N |
| Literature Reference Author | T.FUJIOKA,K.YOSHIDA,H.FUJII,T.NAGAO,H.OKABE,K.MIHASHI |
| Literature Reference Citation | CHEM.PHARM.BULL.,51,365(2003) |
| Literature Reference DOI | 10.1248/cpb.51.365 |
| Molecular Weight | 915.126 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS21217 |