| SpectraBase Compound ID | GQrk1EiMbGI |
|---|---|
| InChI | InChI=1S/C38H56O13/c1-18(40)51-33(2,3)13-12-25(42)38(9,48)30-21(41)15-35(6)24-11-10-19-20(37(24,8)26(43)16-36(30,35)7)14-22(31(47)34(19,4)5)49-32-29(46)28(45)27(44)23(17-39)50-32/h10,14,20-21,23-24,27-30,32,39,41,44-46,48H,11-13,15-17H2,1-9H3/t20-,21-,23+,24+,27+,28-,29+,30+,32+,35+,36-,37+,38?/m1/s1 |
| InChIKey | FZZZUXSEPKGDPU-QAHGDORVSA-N |
| Mol Weight | 720.9 g/mol |
| Molecular Formula | C38H56O13 |
| Exact Mass | 720.372092 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 51uka3AnnRb |
|---|---|
| Name | 25-O-ACETYL-BRYOAMARIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H56O13 |
| InChI | InChI=1S/C38H56O13/c1-18(40)51-33(2,3)13-12-25(42)38(9,48)30-21(41)15-35(6)24-11-10-19-20(37(24,8)26(43)16-36(30,35)7)14-22(31(47)34(19,4)5)49-32-29(46)28(45)27(44)23(17-39)50-32/h10,14,20-21,23-24,27-30,32,39,41,44-46,48H,11-13,15-17H2,1-9H3/t20-,21-,23+,24+,27+,28-,29+,30+,32+,35+,36-,37+,38?/m1/s1 |
| InChIKey | FZZZUXSEPKGDPU-QAHGDORVSA-N |
| Literature Reference Author | T.SEKIME,H.KURIHARA,M.WAKU,F.IKEGAMI,N.RUANGRUNGSI |
| Literature Reference Citation | CHEM.PHARM.BULL.,50,645(2002) |
| Literature Reference DOI | 10.1248/cpb.50.645 |
| Molecular Weight | 720.855 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN8159 |