| SpectraBase Compound ID | JaAcfPQ6nUQ |
|---|---|
| InChI | InChI=1S/C59H110N2O17/c1-4-6-8-10-12-14-16-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-49(67)61-44(51(68)45(64)37-35-33-31-29-27-17-15-13-11-9-7-5-2)41-75-57-55(72)54(71)53(70)48(77-57)42-76-59(58(73)74)39-46(65)50(60-43(3)63)56(78-59)52(69)47(66)40-62/h18-19,44-48,50-57,62,64-66,68-72H,4-17,20-42H2,1-3H3,(H,60,63)(H,61,67)(H,73,74)/b19-18+/t44?,45?,46-,47-,48+,50+,51?,52+,53+,54-,55+,56+,57+,59+/m0/s1 |
| InChIKey | LNBYCJGYHKLCIH-OAUVCNOPSA-N |
| Mol Weight | 1119.5 g/mol |
| Molecular Formula | C59H110N2O17 |
| Exact Mass | 1118.78045 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Kpyu6r30VFV |
|---|---|
| Name | LNBYCJGYHKLCIH-OAUVCNOPSA-N |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C59H110N2O17 |
| InChI | InChI=1S/C59H110N2O17/c1-4-6-8-10-12-14-16-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-49(67)61-44(51(68)45(64)37-35-33-31-29-27-17-15-13-11-9-7-5-2)41-75-57-55(72)54(71)53(70)48(77-57)42-76-59(58(73)74)39-46(65)50(60-43(3)63)56(78-59)52(69)47(66)40-62/h18-19,44-48,50-57,62,64-66,68-72H,4-17,20-42H2,1-3H3,(H,60,63)(H,61,67)(H,73,74)/b19-18+/t44?,45?,46-,47-,48+,50+,51?,52+,53+,54-,55+,56+,57+,59+/m0/s1 |
| InChIKey | LNBYCJGYHKLCIH-OAUVCNOPSA-N |
| Literature Reference Author | K.YAMADA,K.TANABE,T.MIYAMOTO,T.KUSUMOTO,M.INAGAKI,R.HIGUCHI |
| Literature Reference Citation | CHEM.PHARM.BULL.,56,734(2008) |
| Literature Reference DOI | 10.1248/cpb.56.734 |
| Molecular Weight | 1119.526 g/mol |
| Sample ID | 1736 |
| Solvent | C5D5N |