| SpectraBase Compound ID | IQGD6akBohT |
|---|---|
| InChI | InChI=1S/C28H31NO9/c1-14-9-21(37-22(33)10-15-4-6-17(31)7-5-15)25-18(12-29-8-2-3-19(29)27(34)35)28(36)38-26(25)24-16(13-30)11-20(32)23(14)24/h4-7,11,18-19,21,24-26,30-31H,2-3,8-10,12-13H2,1H3,(H,34,35)/t18-,19?,21-,24-,25+,26+/m0/s1 |
| InChIKey | CQBJKIZHLSYGOO-SJLRQSLESA-N |
| Mol Weight | 525.55 g/mol |
| Molecular Formula | C28H31NO9 |
| Exact Mass | 525.199882 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B1FPxS7bDmB |
|---|---|
| Name | 11-BETA,13-DIHYDRO-13-PROLYL-LACTUCOPICRIN |
| Compound Number | 15 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H31NO9 |
| InChI | InChI=1S/C28H31NO9/c1-14-9-21(37-22(33)10-15-4-6-17(31)7-5-15)25-18(12-29-8-2-3-19(29)27(34)35)28(36)38-26(25)24-16(13-30)11-20(32)23(14)24/h4-7,11,18-19,21,24-26,30-31H,2-3,8-10,12-13H2,1H3,(H,34,35)/t18-,19?,21-,24-,25+,26+/m0/s1 |
| InChIKey | CQBJKIZHLSYGOO-SJLRQSLESA-N |
| Literature Reference Author | T.WARASHINA,T.MIYASE |
| Literature Reference Citation | CHEM.PHARM.BULL.,56,1445(2008) |
| Literature Reference DOI | 10.1248/cpb.56.1445 |
| Molecular Weight | 525.555 g/mol |
| Sample ID | 2291 |
| Solvent | C5D5N |