| SpectraBase Compound ID | IAFkwZ8wyaA |
|---|---|
| InChI | InChI=1S/C30H48O8/c1-19-10-8-12-20(2)14-16-24(17-15-21(3)13-9-11-19)30(6,7)38-29-27(34)26(33)28(36-23(5)32)25(37-29)18-35-22(4)31/h10,13-14,24-29,33-34H,8-9,11-12,15-18H2,1-7H3/b19-10+,20-14+,21-13+/t24-,25+,26+,27+,28+,29-/m1/s1 |
| InChIKey | DGESVYZTFUSWEA-RTMHYDQNSA-N |
| Mol Weight | 536.7 g/mol |
| Molecular Formula | C30H48O8 |
| Exact Mass | 536.334918 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4FTFkRQLZ2I |
|---|---|
| Name | CALYCULAGLYCOSIDE-B |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O8 |
| InChI | InChI=1S/C30H48O8/c1-19-10-8-12-20(2)14-16-24(17-15-21(3)13-9-11-19)30(6,7)38-29-27(34)26(33)28(36-23(5)32)25(37-29)18-35-22(4)31/h10,13-14,24-29,33-34H,8-9,11-12,15-18H2,1-7H3/b19-10+,20-14+,21-13+/t24-,25+,26+,27+,28+,29-/m1/s1 |
| InChIKey | DGESVYZTFUSWEA-RTMHYDQNSA-N |
| Literature Reference Author | Y.P.SHI,A.D.RODRIGUEZ,O.L.PADILLA |
| Literature Reference Citation | J.NAT.PROD.,64,1439(2001) |
| Literature Reference DOI | 10.1021/np0104121 |
| Molecular Weight | 536.706 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI2311 |