| SpectraBase Compound ID | 9tRUFU9YqbZ |
|---|---|
| InChI | InChI=1S/C48H82O20/c1-21(2)24(68-61)10-16-48(8,67-42-39(60)36(57)33(54)26(19-50)63-42)22-9-14-47(7)31(22)23(52)17-29-45(5)13-12-30(44(3,4)28(45)11-15-46(29,47)6)65-43-40(37(58)34(55)27(20-51)64-43)66-41-38(59)35(56)32(53)25(18-49)62-41/h22-43,49-61H,1,9-20H2,2-8H3/t22-,23+,24?,25+,26+,27+,28-,29+,30-,31-,32+,33+,34+,35-,36-,37-,38+,39+,40+,41-,42-,43-,45-,46+,47+,48-/m0/s1 |
| InChIKey | QCCQLRNQOAQMKU-JECDWVISSA-N |
| Mol Weight | 979.2 g/mol |
| Molecular Formula | C48H82O20 |
| Exact Mass | 978.539945 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AcbRp0hwYhP |
|---|---|
| Name | QCCQLRNQOAQMKU-JECDWVISSA-N |
| Compound Number | 13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H82O20 |
| InChI | InChI=1S/C48H82O20/c1-21(2)24(68-61)10-16-48(8,67-42-39(60)36(57)33(54)26(19-50)63-42)22-9-14-47(7)31(22)23(52)17-29-45(5)13-12-30(44(3,4)28(45)11-15-46(29,47)6)65-43-40(37(58)34(55)27(20-51)64-43)66-41-38(59)35(56)32(53)25(18-49)62-41/h22-43,49-61H,1,9-20H2,2-8H3/t22-,23+,24?,25+,26+,27+,28-,29+,30-,31-,32+,33+,34+,35-,36-,37-,38+,39+,40+,41-,42-,43-,45-,46+,47+,48-/m0/s1 |
| InChIKey | QCCQLRNQOAQMKU-JECDWVISSA-N |
| Literature Reference Author | M.YOSHIKAWA,T.MURAKAMI,T.UENO,N.HIROKAWA,K.YASHIRO,N.MURAKAM I,J.YAMAHARA,H.MATSU |
| Literature Reference Citation | CHEM.PHARM.BULL.,45,1056(1997) |
| Literature Reference DOI | 10.1248/cpb.45.1056 |
| Molecular Weight | 979.167 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN28908 |