| SpectraBase Compound ID | 33a8W6HIXhs |
|---|---|
| InChI | InChI=1S/C49H76O11/c1-34(22-17-13-11-9-8-10-12-14-19-24-40(50)30-35(2)28-29-46(54)55)31-43(52)37(4)45-32-41(51)25-21-27-42(59-7)26-20-16-15-18-23-36(3)48(57)39(6)49(58)38(5)44(53)33-47(56)60-45/h8-20,22,30-31,36-45,48-53,57-58H,21,23-29,32-33H2,1-7H3,(H,54,55)/b9-8+,12-10+,13-11+,18-15+,19-14+,20-16-,22-17+,34-31+,35-30+ |
| InChIKey | VHPBIOVAVQXSJO-LOLCBPPLSA-N |
| Mol Weight | 841.1 g/mol |
| Molecular Formula | C49H76O11 |
| Exact Mass | 840.538763 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HfEs92ejb1k |
|---|---|
| Name | ETNANGIEN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H76O11 |
| InChI | InChI=1S/C49H76O11/c1-34(22-17-13-11-9-8-10-12-14-19-24-40(50)30-35(2)28-29-46(54)55)31-43(52)37(4)45-32-41(51)25-21-27-42(59-7)26-20-16-15-18-23-36(3)48(57)39(6)49(58)38(5)44(53)33-47(56)60-45/h8-20,22,30-31,36-45,48-53,57-58H,21,23-29,32-33H2,1-7H3,(H,54,55)/b9-8+,12-10+,13-11+,18-15+,19-14+,20-16-,22-17+,34-31+,35-30+ |
| InChIKey | VHPBIOVAVQXSJO-LOLCBPPLSA-N |
| Literature Reference Author | H.IRSCHIK,D.SCHUMMER,G.HOEFLE,H.REICHENBACH,H.STEINMETZ,R.JA NSEN |
| Literature Reference Citation | J.NAT.PROD.,70,1060(2007) |
| Literature Reference DOI | 10.1021/np070115h |
| Molecular Weight | 841.136 g/mol |
| Sample ID | 30563 |
| Solvent | ACETONE-D6 |