| SpectraBase Compound ID | LsNO28duZ0z |
|---|---|
| InChI | InChI=1S/C25H30O13/c1-10-16(36-18(29)5-3-11-2-4-14(27)15(28)6-11)7-12-13(23(33)34)9-35-24(19(10)12)38-25-22(32)21(31)20(30)17(8-26)37-25/h2-6,9-10,12,16-17,19-22,24-28,30-32H,7-8H2,1H3,(H,33,34)/b5-3+/t10-,12+,16+,17-,19+,20-,21+,22-,24-,25+/m0/s1 |
| InChIKey | NLTMPTNUZZBBDK-KCJIXDPSSA-N |
| Mol Weight | 538.5 g/mol |
| Molecular Formula | C25H30O13 |
| Exact Mass | 538.168641 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ld2JGrBOjSr |
|---|---|
| Name | 7-EPI-7-O-(E)-CAFFEOYL-LOGANIC-ACID |
| Compound Number | 21 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H30O13 |
| InChI | InChI=1S/C25H30O13/c1-10-16(36-18(29)5-3-11-2-4-14(27)15(28)6-11)7-12-13(23(33)34)9-35-24(19(10)12)38-25-22(32)21(31)20(30)17(8-26)37-25/h2-6,9-10,12,16-17,19-22,24-28,30-32H,7-8H2,1H3,(H,33,34)/b5-3+/t10-,12+,16+,17-,19+,20-,21+,22-,24-,25+/m0/s1 |
| InChIKey | NLTMPTNUZZBBDK-KCJIXDPSSA-N |
| Literature Reference Author | B.DINDA,S.DEBNATH,R.BANIK |
| Literature Reference Citation | CHEM.PHARM.BULL.,59,803(2011) |
| Literature Reference DOI | 10.1248/cpb.59.803 |
| Molecular Weight | 538.505 g/mol |
| Source File Reference | UWIR3251 |