| SpectraBase Compound ID | CfiRIkO9uJr |
|---|---|
| InChI | InChI=1S/C42H68O13/c1-21-29(47)34(55-35-32(50)31(49)30(48)24(18-43)53-35)33(51)36(52-21)54-28-11-12-38(4)25(39(28,5)19-44)10-13-40(6)26(38)9-8-22-23-16-37(2,3)14-15-42(23,20-45)27(46)17-41(22,40)7/h8-9,21,24-36,43-51H,10-20H2,1-7H3/t21?,24-,25?,26?,27-,28+,29?,30-,31+,32-,33?,34?,35+,36?,38+,39+,40-,41-,42-/m1/s1 |
| InChIKey | WRYJYFCCMSVEPQ-AWNQWCHISA-N |
| Mol Weight | 781.0 g/mol |
| Molecular Formula | C42H68O13 |
| Exact Mass | 780.465992 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6GPbDMHDQtV |
|---|---|
| Name | WRYJYFCCMSVEPQ-AWNQWCHISA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H68O13 |
| InChI | InChI=1S/C42H68O13/c1-21-29(47)34(55-35-32(50)31(49)30(48)24(18-43)53-35)33(51)36(52-21)54-28-11-12-38(4)25(39(28,5)19-44)10-13-40(6)26(38)9-8-22-23-16-37(2,3)14-15-42(23,20-45)27(46)17-41(22,40)7/h8-9,21,24-36,43-51H,10-20H2,1-7H3/t21?,24-,25?,26?,27-,28+,29?,30-,31+,32-,33?,34?,35+,36?,38+,39+,40-,41-,42-/m1/s1 |
| InChIKey | WRYJYFCCMSVEPQ-AWNQWCHISA-N |
| Literature Reference Author | J.-K.DING,H.FUJINO,R.KASAI,N.FUJIMOTO,O.TANAKA,J.ZHOU,H.MATS UURA,T.FUWA |
| Literature Reference Citation | CHEM.PHARM.BULL.,34,1158(1986) |
| Literature Reference DOI | 10.1248/cpb.34.1158 |
| Molecular Weight | 780.994 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBK181 |