| SpectraBase Compound ID | D8KCqOCmWZF |
|---|---|
| InChI | InChI=1S/C45H74O14/c1-13-16-32-27(7)35(57-44-41(51)40(50)39(49)30(10)56-44)22-45(53,59-32)29(9)38(48)28(8)42-33(54-11)18-15-17-23(3)19-25(5)36(46)31(14-2)37(47)26(6)20-24(4)21-34(55-12)43(52)58-42/h13,15-18,20-21,25-33,35-42,44,46-51,53H,14,19,22H2,1-12H3/b16-13+,18-15+,23-17+,24-20+,34-21-/t25?,26?,27?,28?,29?,30-,31?,32?,33?,35?,36?,37?,38?,39-,40+,41+,42?,44-,45?/m0/s1 |
| InChIKey | ILXDBTYMIBFXON-HQOFOOHFSA-N |
| Mol Weight | 839.1 g/mol |
| Molecular Formula | C45H74O14 |
| Exact Mass | 838.507857 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KosI8f2yKvF |
|---|---|
| Name | TAN-1323-C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H74O14 |
| InChI | InChI=1S/C45H74O14/c1-13-16-32-27(7)35(57-44-41(51)40(50)39(49)30(10)56-44)22-45(53,59-32)29(9)38(48)28(8)42-33(54-11)18-15-17-23(3)19-25(5)36(46)31(14-2)37(47)26(6)20-24(4)21-34(55-12)43(52)58-42/h13,15-18,20-21,25-33,35-42,44,46-51,53H,14,19,22H2,1-12H3/b16-13+,18-15+,23-17+,24-20+,34-21-/t25?,26?,27?,28?,29?,30-,31?,32?,33?,35?,36?,37?,38?,39-,40+,41+,42?,44-,45?/m0/s1 |
| InChIKey | ILXDBTYMIBFXON-HQOFOOHFSA-N |
| Literature Reference Author | T.ISHII,T.HIDA,S.IINUMA,M.MUROI,Y.NOZAKI |
| Literature Reference Citation | J.ANTIBIOTICS,48,12(1995) |
| Literature Reference DOI | 10.7164/antibiotics.48.12 |
| Molecular Weight | 839.074 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWRU2847 |