| SpectraBase Compound ID | LVEqhPJRhBg |
|---|---|
| InChI | InChI=1S/C50H76O20/c1-21-31(55)33(57)36(60)42(66-21)69-39-27(20-64-22(2)51)68-41(38(62)35(39)59)65-19-26-32(56)34(58)37(61)43(67-26)70-44(63)50-15-14-48(8)23(24(50)17-45(3,4)30(54)18-50)16-25(52)40-47(7)12-11-29(53)46(5,6)28(47)10-13-49(40,48)9/h16,21,24-28,31-43,52,55-62H,10-15,17-20H2,1-9H3/t21-,24+,25-,26-,27-,28+,31-,32-,33+,34+,35-,36+,37-,38-,39-,40-,41-,42-,43+,47+,48-,49-,50-/m1/s1 |
| InChIKey | GLWQVVDKVKBHJO-NFVQJOOFSA-N |
| Mol Weight | 997.1 g/mol |
| Molecular Formula | C50H76O20 |
| Exact Mass | 996.492995 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FlBnOOlWFSA |
|---|---|
| Name | PAPYRIOSIDE_LA;11-ALPHA-HYDROXY-3,21-DIOXOOLEAN-12-EN-28-OYL-ALPHA-L-RHAMNOPYRANOSYL-(1->4)-(6-O-ACETYL-BETA-D-GLUCOPYRANOSYL) |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H76O20 |
| InChI | InChI=1S/C50H76O20/c1-21-31(55)33(57)36(60)42(66-21)69-39-27(20-64-22(2)51)68-41(38(62)35(39)59)65-19-26-32(56)34(58)37(61)43(67-26)70-44(63)50-15-14-48(8)23(24(50)17-45(3,4)30(54)18-50)16-25(52)40-47(7)12-11-29(53)46(5,6)28(47)10-13-49(40,48)9/h16,21,24-28,31-43,52,55-62H,10-15,17-20H2,1-9H3/t21-,24+,25-,26-,27-,28+,31-,32-,33+,34+,35-,36+,37-,38-,39-,40-,41-,42-,43+,47+,48-,49-,50-/m1/s1 |
| InChIKey | GLWQVVDKVKBHJO-NFVQJOOFSA-N |
| Literature Reference Author | K.KOJIMA,I.SARACOGLU,M.MUTSUGA,Y.OGIHARA |
| Literature Reference Citation | CHEM.PHARM.BULL.,44,2107(1996) |
| Literature Reference DOI | 10.1248/cpb.44.2107 |
| Molecular Weight | 997.141 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ17420 |