| SpectraBase Compound ID | 4MTD6LMomAc |
|---|---|
| InChI | InChI=1S/C21H32O11/c1-9(2)4-12(23)28-8-19-11-5-21(19,18(3)7-20(11,27)32-17(19)31-18)30-16-15(26)14(25)13(24)10(6-22)29-16/h9-11,13-17,22,24-27H,4-8H2,1-3H3/t10-,11+,13-,14+,15-,16+,17+,18-,19-,20+,21-/m0/s1 |
| InChIKey | FWCLZRQEJIJOLN-JUPHXDMMSA-N |
| Mol Weight | 460.5 g/mol |
| Molecular Formula | C21H32O11 |
| Exact Mass | 460.194462 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7NDlubNdgnD |
|---|---|
| Name | 8-O-ISOVALERYL-DESBENZOYLPAEONIFLORIN |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H32O11 |
| InChI | InChI=1S/C21H32O11/c1-9(2)4-12(23)28-8-19-11-5-21(19,18(3)7-20(11,27)32-17(19)31-18)30-16-15(26)14(25)13(24)10(6-22)29-16/h9-11,13-17,22,24-27H,4-8H2,1-3H3/t10-,11+,13-,14+,15-,16+,17+,18-,19-,20+,21-/m0/s1 |
| InChIKey | FWCLZRQEJIJOLN-JUPHXDMMSA-N |
| Literature Reference Author | T.TANAKA,M.KATAOKA,N.TSUBOI,I.KOUNO |
| Literature Reference Citation | CHEM.PHARM.BULL.,48,201(2000) |
| Literature Reference DOI | 10.1248/cpb.48.201 |
| Molecular Weight | 460.478 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU4900 |