| SpectraBase Compound ID | Gpo6rhDda6p |
|---|---|
| InChI | InChI=1S/C48H82O17/c1-22-31(51)34(54)36(56)40(59-22)63-38-33(53)26(20-49)61-42(39(38)64-41-37(57)35(55)32(52)23(2)60-41)62-29-14-16-44(5)27(43(29,3)4)13-18-46(7)28(44)11-10-24-25(12-17-45(24,46)6)48(9)19-15-30(65-48)47(8,58)21-50/h22-42,49-58H,10-21H2,1-9H3/t22-,23+,24?,25-,26+,27?,28?,29-,30+,31-,32+,33+,34+,35-,36+,37-,38-,39+,40-,41+,42-,44-,45+,46+,47?,48+/m0/s1 |
| InChIKey | DDJKYWYYONWKQZ-GMXUDCMFSA-N |
| Mol Weight | 931.2 g/mol |
| Molecular Formula | C48H82O17 |
| Exact Mass | 930.555201 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3ZosSe48sZl |
|---|---|
| Name | NEOALSOSIDE-H1 |
| Compound Number | 20 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H82O17 |
| InChI | InChI=1S/C48H82O17/c1-22-31(51)34(54)36(56)40(59-22)63-38-33(53)26(20-49)61-42(39(38)64-41-37(57)35(55)32(52)23(2)60-41)62-29-14-16-44(5)27(43(29,3)4)13-18-46(7)28(44)11-10-24-25(12-17-45(24,46)6)48(9)19-15-30(65-48)47(8,58)21-50/h22-42,49-58H,10-21H2,1-9H3/t22-,23+,24?,25-,26+,27?,28?,29-,30+,31-,32+,33+,34+,35-,36+,37-,38-,39+,40-,41+,42-,44-,45+,46+,47?,48+/m0/s1 |
| InChIKey | DDJKYWYYONWKQZ-GMXUDCMFSA-N |
| Literature Reference Author | S.FUJITA,R.KASAI,K.OHTANI,K.YAMASAKI,M.H.CHIU,R.L.NIE,O.TANA KA |
| Literature Reference Citation | PHYTOCHEM.,38,465(1995) |
| Literature Reference DOI | 10.1016/0031-9422(94)00608-V |
| Molecular Weight | 931.169 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS4799 |