| SpectraBase Compound ID | Bq7vk2e55db |
|---|---|
| InChI | InChI=1S/C25H30O11/c1-25(32)10-9-14-15(22(30)31)12-33-23(18(14)25)36-24-21(20(29)19(28)16(11-26)34-24)35-17(27)8-7-13-5-3-2-4-6-13/h2-8,12,14,16,18-21,23-24,26,28-29,32H,9-11H2,1H3,(H,30,31)/b8-7+/t14-,16+,18-,19+,20-,21+,23+,24-,25+/m1/s1 |
| InChIKey | BIZBWPKKEHPFMI-CCFHSKMBSA-N |
| Mol Weight | 506.5 g/mol |
| Molecular Formula | C25H30O11 |
| Exact Mass | 506.178812 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 43xWCIuKYJI |
|---|---|
| Name | 2'-O-CINNAMOYL-MUSSAENOSIDIC_ACID |
| Compound Number | 187 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H30O11 |
| InChI | InChI=1S/C25H30O11/c1-25(32)10-9-14-15(22(30)31)12-33-23(18(14)25)36-24-21(20(29)19(28)16(11-26)34-24)35-17(27)8-7-13-5-3-2-4-6-13/h2-8,12,14,16,18-21,23-24,26,28-29,32H,9-11H2,1H3,(H,30,31)/b8-7+/t14-,16+,18-,19+,20-,21+,23+,24-,25+/m1/s1 |
| InChIKey | BIZBWPKKEHPFMI-CCFHSKMBSA-N |
| Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
| Literature Reference Citation | J.NAT.PROD.,53,1055(1990) |
| Literature Reference DOI | 10.1021/np50071a001 |
| Molecular Weight | 506.507 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ16170 |