| SpectraBase Compound ID | 8MYqOX8PBRx |
|---|---|
| InChI | InChI=1S/C15H16O7/c1-6(16)9-11-15(22-13(9)18)4-3-7-8(12(17)19-2)5-20-14(21-11)10(7)15/h3-7,9-11,14,16H,1-2H3/t6-,7?,9?,10?,11?,14+,15-/m0/s1 |
| InChIKey | RMYLCIMGXGYTTK-NNXIBREJSA-N |
| Mol Weight | 308.29 g/mol |
| Molecular Formula | C15H16O7 |
| Exact Mass | 308.089603 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DVGcrvEG3ZI |
|---|---|
| Name | ISO-ALLAMANDICIN |
| Compound Number | 40 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C15H16O7 |
| InChI | InChI=1S/C15H16O7/c1-6(16)9-11-15(22-13(9)18)4-3-7-8(12(17)19-2)5-20-14(21-11)10(7)15/h3-7,9-11,14,16H,1-2H3/t6-,7?,9?,10?,11?,14+,15-/m0/s1 |
| InChIKey | RMYLCIMGXGYTTK-NNXIBREJSA-N |
| Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
| Literature Reference Citation | J.NAT.PROD.,54,1173(1991) |
| Literature Reference DOI | 10.1021/np50077a001 |
| Molecular Weight | 308.288 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCS4420 |