| SpectraBase Compound ID | 9NZWKb7NXKp |
|---|---|
| InChI | InChI=1S/C28H40O7/c1-12(2)10-18-11-14(4)19-9-8-13(3)20-22(19)21(18)15(5)23(30)27(20)35-28-25(32)24(31)26(16(6)33-28)34-17(7)29/h10,13-14,16,18-19,24-26,28,30-32H,8-9,11H2,1-7H3/t13-,14+,16+,18+,19-,24+,25+,26-,28+/m0/s1 |
| InChIKey | NCLOUSJJVQDYSE-IPIONZDJSA-N |
| Mol Weight | 488.6 g/mol |
| Molecular Formula | C28H40O7 |
| Exact Mass | 488.277404 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BGX0L4nYdjB |
|---|---|
| Name | PSEUDOPTEROSIN-J |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H40O7 |
| InChI | InChI=1S/C28H40O7/c1-12(2)10-18-11-14(4)19-9-8-13(3)20-22(19)21(18)15(5)23(30)27(20)35-28-25(32)24(31)26(16(6)33-28)34-17(7)29/h10,13-14,16,18-19,24-26,28,30-32H,8-9,11H2,1-7H3/t13-,14+,16+,18+,19-,24+,25+,26-,28+/m0/s1 |
| InChIKey | NCLOUSJJVQDYSE-IPIONZDJSA-N |
| Literature Reference Author | V.ROUSSIS,Z.WU,W.FENICAL,S.A.STROBEL,G.D.VANDUYNE,J.CLARDY |
| Literature Reference Citation | J.ORG.CHEM.,55,4916(1990) |
| Literature Reference DOI | 10.1021/jo00303a030 |
| Molecular Weight | 488.621 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED11538 |