| SpectraBase Compound ID | G6hl1roLE2n |
|---|---|
| InChI | InChI=1S/C28H44O10/c1-7-20(5)27(34)38-25-23(16-31)37-28(24(33)26(25)35-21(6)32)36-22(14-18(3)11-12-29)13-17(2)9-8-10-19(4)15-30/h7,10-11,13,22-26,28-31,33H,8-9,12,14-16H2,1-6H3/b17-13+,18-11+,19-10+,20-7-/t22?,23-,24-,25-,26-,28-/m0/s1 |
| InChIKey | PVPQAWFRHMRXPB-YBWFUIMCSA-N |
| Mol Weight | 540.7 g/mol |
| Molecular Formula | C28H44O10 |
| Exact Mass | 540.293448 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ly7hJplzU2W |
|---|---|
| Name | 1,5,12-TRIHYDROXY-5-O-(3'-O-ACETYL-4'-O-ANGELOYL-BETA-D-GLUCOPYRANOSYL)-FARNESOL |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H44O10 |
| InChI | InChI=1S/C28H44O10/c1-7-20(5)27(34)38-25-23(16-31)37-28(24(33)26(25)35-21(6)32)36-22(14-18(3)11-12-29)13-17(2)9-8-10-19(4)15-30/h7,10-11,13,22-26,28-31,33H,8-9,12,14-16H2,1-6H3/b17-13+,18-11+,19-10+,20-7-/t22?,23-,24-,25-,26-,28-/m0/s1 |
| InChIKey | PVPQAWFRHMRXPB-YBWFUIMCSA-N |
| Literature Reference Author | A.A.AHMED |
| Literature Reference Citation | J.NAT.PROD.,55,824(1992) |
| Literature Reference DOI | 10.1021/np50084a022 |
| Molecular Weight | 540.651 g/mol |
| Solvent | Unknown |
| Source File Reference | UWTS510 |