| SpectraBase Compound ID | 1t2qo9nzkDS |
|---|---|
| InChI | InChI=1S/C28H40O7/c1-12(2)10-18-11-14(4)19-9-8-13(3)20-22(19)21(18)15(5)26(24(20)31)35-28-25(32)27(34-17(7)29)23(30)16(6)33-28/h10,13-14,16,18-19,23,25,27-28,30-32H,8-9,11H2,1-7H3/t13-,14-,16+,18+,19+,23-,25+,27-,28+/m1/s1 |
| InChIKey | REFOFWBTJBXTFK-RUGJCETESA-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 | 4duxziGSnks |
|---|---|
| Name | PSEUDOPTEROSIN-Q |
| Compound Number | 2 |
| 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)26(24(20)31)35-28-25(32)27(34-17(7)29)23(30)16(6)33-28/h10,13-14,16,18-19,23,25,27-28,30-32H,8-9,11H2,1-7H3/t13-,14-,16+,18+,19+,23-,25+,27-,28+/m1/s1 |
| InChIKey | REFOFWBTJBXTFK-RUGJCETESA-N |
| Literature Reference Author | I.I.RODRIGUEZ,Y.P.SHI,O.J.GARCIA,A.D.RODRIGUEZ,A.M.S.MAYER,J .A.SANCHEZ,E.ORTEGA- |
| Literature Reference Citation | J.NAT.PROD.,67,1672(2004) |
| Literature Reference DOI | 10.1021/np049802o |
| Molecular Weight | 488.621 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ6526 |