| SpectraBase Compound ID | El6lfSuBar3 |
|---|---|
| InChI | InChI=1S/C37H40O11/c1-39-24-19-23(21-16-12-9-13-17-21)47-34-26(24)29(38)35(43-5)37(45-7)36(34,44-6)28-30(48-37)27-25(40-2)18-22(20-14-10-8-11-15-20)46-31(27)33(42-4)32(28)41-3/h8-17,22-25,35H,18-19H2,1-7H3/t22-,23-,24+,25+,35-,36+,37+/m0/s1 |
| InChIKey | ZLPZBRHUFQZUJP-NPVWWCBZSA-N |
| Mol Weight | 660.7 g/mol |
| Molecular Formula | C37H40O11 |
| Exact Mass | 660.257062 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | INjsTomtAlL |
|---|---|
| Name | CALYFLORENONE-A |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H40O11 |
| InChI | InChI=1S/C37H40O11/c1-39-24-19-23(21-16-12-9-13-17-21)47-34-26(24)29(38)35(43-5)37(45-7)36(34,44-6)28-30(48-37)27-25(40-2)18-22(20-14-10-8-11-15-20)46-31(27)33(42-4)32(28)41-3/h8-17,22-25,35H,18-19H2,1-7H3/t22-,23-,24+,25+,35-,36+,37+/m0/s1 |
| InChIKey | ZLPZBRHUFQZUJP-NPVWWCBZSA-N |
| Literature Reference Author | R.MAYER |
| Literature Reference Citation | J.NAT.PROD.,62,1274(1999) |
| Literature Reference DOI | 10.1021/np990182e |
| Molecular Weight | 660.718 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP8659 |