| SpectraBase Compound ID | KfI55eBESbl |
|---|---|
| InChI | InChI=1S/C30H44O10/c1-8-9-10-11-24(33)39-22-13-12-16(2)14-23-30(36,18(4)28(35)40-23)26(34)25-17(3)15-21(37-19(5)31)27(29(22,25)7)38-20(6)32/h14-15,18,21-23,25-27,34,36H,8-13H2,1-7H3/b16-14-/t18?,21-,22+,23+,25-,26+,27+,29-,30-/m1/s1 |
| InChIKey | RHQDEEDZJCZIOP-JDUQKTNLSA-N |
| Mol Weight | 564.7 g/mol |
| Molecular Formula | C30H44O10 |
| Exact Mass | 564.293448 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1WWRbASSNlD |
|---|---|
| Name | CAVERNULINE |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H44O10 |
| InChI | InChI=1S/C30H44O10/c1-8-9-10-11-24(33)39-22-13-12-16(2)14-23-30(36,18(4)28(35)40-23)26(34)25-17(3)15-21(37-19(5)31)27(29(22,25)7)38-20(6)32/h14-15,18,21-23,25-27,34,36H,8-13H2,1-7H3/b16-14-/t18?,21-,22+,23+,25-,26+,27+,29-,30-/m1/s1 |
| InChIKey | RHQDEEDZJCZIOP-JDUQKTNLSA-N |
| Literature Reference Author | A.CLASTRES,P.LABOUTE,A.AHOND,C.POUPAT,P.POTIER |
| Literature Reference Citation | J.NAT.PROD.,47,162(1984) |
| Literature Reference DOI | 10.1021/np50031a023 |
| Molecular Weight | 564.673 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS3613 |