| SpectraBase Compound ID | F4A03pGQMZp |
|---|---|
| InChI | InChI=1S/C31H52O3/c1-19(2)16-21(32)17-20(3)22-12-13-31(8)27-25(34-9)18-24-23(10-11-26(33)28(24,4)5)29(27,6)14-15-30(22,31)7/h16,18,20-23,25-27,32-33H,10-15,17H2,1-9H3/t20-,21?,22-,23-,25+,26+,27-,29+,30-,31+/m1/s1 |
| InChIKey | MTYMFIWYWSHNSU-BTRNMYBISA-N |
| Mol Weight | 472.8 g/mol |
| Molecular Formula | C31H52O3 |
| Exact Mass | 472.391646 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BtEpfkrUjE9 |
|---|---|
| Name | KARAVILAGENIN-C;7-METHOXY-CUCURBITA-5,24-DIEN-3-BETA,23-XI-DIOL |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H52O3 |
| InChI | InChI=1S/C31H52O3/c1-19(2)16-21(32)17-20(3)22-12-13-31(8)27-25(34-9)18-24-23(10-11-26(33)28(24,4)5)29(27,6)14-15-30(22,31)7/h16,18,20-23,25-27,32-33H,10-15,17H2,1-9H3/t20-,21?,22-,23-,25+,26+,27-,29+,30-,31+/m1/s1 |
| InChIKey | MTYMFIWYWSHNSU-BTRNMYBISA-N |
| Literature Reference Author | S.NAKAMURA,T.MURAKAMI,J.NAKAMURA,H.KOBAYASHI,H.MATSUDA,M.YOS HIKAWA |
| Literature Reference Citation | CHEM.PHARM.BULL.,54,1545(2006) |
| Literature Reference DOI | 10.1248/cpb.54.1545 |
| Molecular Weight | 472.752 g/mol |
| Sample ID | 55301 |
| Solvent | C5D5N |