| SpectraBase Compound ID | 7dInGmOlXdP |
|---|---|
| InChI | InChI=1S/C48H82O19/c1-21(9-13-31(45(4,5)61)67-43-40(60)37(57)34(54)27(65-43)20-62-41-38(58)35(55)32(52)25(18-49)63-41)22-15-16-46(6)28-12-10-23-24(48(28,8)29(51)17-47(22,46)7)11-14-30(44(23,2)3)66-42-39(59)36(56)33(53)26(19-50)64-42/h10,21-22,24-43,49-61H,9,11-20H2,1-8H3/t21?,22-,24-,25+,26-,27+,28+,29-,30+,31+,32+,33-,34+,35-,36+,37-,38+,39-,40+,41+,42+,43-,46+,47-,48+/m1/s1 |
| InChIKey | KYVIPFHNYCKOMQ-SKLHGZKFSA-N |
| Mol Weight | 963.2 g/mol |
| Molecular Formula | C48H82O19 |
| Exact Mass | 962.54503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L3bT8RpHH3X |
|---|---|
| Name | MOGROSIDE-III |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H82O19 |
| InChI | InChI=1S/C48H82O19/c1-21(9-13-31(45(4,5)61)67-43-40(60)37(57)34(54)27(65-43)20-62-41-38(58)35(55)32(52)25(18-49)63-41)22-15-16-46(6)28-12-10-23-24(48(28,8)29(51)17-47(22,46)7)11-14-30(44(23,2)3)66-42-39(59)36(56)33(53)26(19-50)64-42/h10,21-22,24-43,49-61H,9,11-20H2,1-8H3/t21?,22-,24-,25+,26-,27+,28+,29-,30+,31+,32+,33-,34+,35-,36+,37-,38+,39-,40+,41+,42+,43-,46+,47-,48+/m1/s1 |
| InChIKey | KYVIPFHNYCKOMQ-SKLHGZKFSA-N |
| Literature Reference Author | D.LI,T.IKEDA,N.MATSUOKA,T.NOHARA,H.ZHANG,T.SAKAMOTO,G.I.NONA KA |
| Literature Reference Citation | CHEM.PHARM.BULL.,54,1425(2006) |
| Literature Reference DOI | 10.1248/cpb.54.1425 |
| Molecular Weight | 963.168 g/mol |
| Sample ID | 55264 |
| Solvent | C5D5N |