| SpectraBase Compound ID | LqzgK2kotnE |
|---|---|
| InChI | InChI=1S/C48H74O17/c1-22-40(51)32(52-7)16-38(57-22)63-41-23(2)58-36(15-29(41)49)64-42-25(4)60-39(18-34(42)54-9)65-43-24(3)59-37(17-33(43)53-8)61-31-14-26-10-11-27-28(46(26,5)19-30(31)50)12-13-48-21-56-47(6)44(48)35(20-55-47)62-45(27)48/h10,22-25,28-44,49-51H,11-21H2,1-9H3/t22-,23+,24+,25+,28+,29-,30-,31-,32+,33-,34-,35-,36-,37-,38+,39+,40-,41+,42-,43+,44-,46+,47-,48+/m1/s1 |
| InChIKey | LSUPAWFDJKFYAS-XNINLILSSA-N |
| Mol Weight | 923.1 g/mol |
| Molecular Formula | C48H74O17 |
| Exact Mass | 922.492601 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 82kn6Bo9wUE |
|---|---|
| Name | SUBLANCEOSIDE-J4 |
| Compound Number | 28 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H74O17 |
| InChI | InChI=1S/C48H74O17/c1-22-40(51)32(52-7)16-38(57-22)63-41-23(2)58-36(15-29(41)49)64-42-25(4)60-39(18-34(42)54-9)65-43-24(3)59-37(17-33(43)53-8)61-31-14-26-10-11-27-28(46(26,5)19-30(31)50)12-13-48-21-56-47(6)44(48)35(20-55-47)62-45(27)48/h10,22-25,28-44,49-51H,11-21H2,1-9H3/t22-,23+,24+,25+,28+,29-,30-,31-,32+,33-,34-,35-,36-,37-,38+,39+,40-,41+,42-,43+,44-,46+,47-,48+/m1/s1 |
| InChIKey | LSUPAWFDJKFYAS-XNINLILSSA-N |
| Literature Reference Author | T.WARASHINA,T.NORO |
| Literature Reference Citation | CHEM.PHARM.BULL.,54,1551(2006) |
| Literature Reference DOI | 10.1248/cpb.54.1551 |
| Molecular Weight | 923.105 g/mol |
| Sample ID | 55393 |
| Solvent | C5D5N |