| SpectraBase Compound ID | IeaYdBHw3hX |
|---|---|
| InChI | InChI=1S/C27H42O4/c1-16(28)31-21-14-20-25(4)12-7-11-24(2,3)18(25)10-13-26(20,5)19-9-8-17-15-30-23(29)22(17)27(19,21)6/h8,18-23,29H,7,9-15H2,1-6H3/t18?,19?,20?,21-,22-,23-,25+,26+,27-/m1/s1 |
| InChIKey | IDZDIJBVDDHIIM-NXKWDWQMSA-N |
| Mol Weight | 430.6 g/mol |
| Molecular Formula | C27H42O4 |
| Exact Mass | 430.30831 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Y7qQ7MFbtG |
|---|---|
| Name | EPI-DEOXOSCALARIN |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H42O4 |
| InChI | InChI=1S/C27H42O4/c1-16(28)31-21-14-20-25(4)12-7-11-24(2,3)18(25)10-13-26(20,5)19-9-8-17-15-30-23(29)22(17)27(19,21)6/h8,18-23,29H,7,9-15H2,1-6H3/t18?,19?,20?,21-,22-,23-,25+,26+,27-/m1/s1 |
| InChIKey | IDZDIJBVDDHIIM-NXKWDWQMSA-N |
| Literature Reference Author | A.FONTANA,P.CAVALIERE,N.UNGUR,L.D'SOUZA,P.S.PARAMESWARAM,G.C IMINO |
| Literature Reference Citation | J.NAT.PROD.,62,1367(1999) |
| Literature Reference DOI | 10.1021/np9900932 |
| Molecular Weight | 430.628 g/mol |
| Solvent | Unknown |
| Source File Reference | UWCS20827 |