| SpectraBase Compound ID | 2y5WDHrwLVG |
|---|---|
| InChI | InChI=1S/C27H40O7/c1-14(2)8-7-9-15(3)19-11-10-16(4)22-20(19)12-17(5)25(24(22)31)34-27-26(33-18(6)28)23(30)21(29)13-32-27/h8,12,15-16,19,21,23,26-27,29-31H,7,9-11,13H2,1-6H3/t15-,16?,19-,21?,23?,26?,27?/m0/s1 |
| InChIKey | PMIXPFOPJYZXRM-NCHXLRPJSA-N |
| Mol Weight | 476.6 g/mol |
| Molecular Formula | C27H40O7 |
| Exact Mass | 476.277404 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4Ew0Ag4okm5 |
|---|---|
| Name | SECO-PSEUDOPTEROSIN-I |
| Compound Number | 13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H40O7 |
| InChI | InChI=1S/C27H40O7/c1-14(2)8-7-9-15(3)19-11-10-16(4)22-20(19)12-17(5)25(24(22)31)34-27-26(33-18(6)28)23(30)21(29)13-32-27/h8,12,15-16,19,21,23,26-27,29-31H,7,9-11,13H2,1-6H3/t15-,16?,19-,21?,23?,26?,27?/m0/s1 |
| InChIKey | PMIXPFOPJYZXRM-NCHXLRPJSA-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 | 476.610 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ6538 |