| SpectraBase Compound ID | 19GHOASyGYD |
|---|---|
| InChI | InChI=1S/C31H52O3/c1-20(11-10-15-27(2,3)34-9)21-14-16-31(8)26-24(32)19-23-22(12-13-25(33)28(23,4)5)29(26,6)17-18-30(21,31)7/h10,15,19-22,24-26,32-33H,11-14,16-18H2,1-9H3/b15-10+/t20-,21-,22-,24+,25+,26-,29+,30-,31+/m1/s1 |
| InChIKey | JITGKINHLQAZRO-SRZVJSNHSA-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 | KdcqZ3BD363 |
|---|---|
| Name | (23-E)-25-METHOXY-CUCURBIT-23-ENE-3-BETA,7-BETA-DIOL |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H52O3 |
| InChI | InChI=1S/C31H52O3/c1-20(11-10-15-27(2,3)34-9)21-14-16-31(8)26-24(32)19-23-22(12-13-25(33)28(23,4)5)29(26,6)17-18-30(21,31)7/h10,15,19-22,24-26,32-33H,11-14,16-18H2,1-9H3/b15-10+/t20-,21-,22-,24+,25+,26-,29+,30-,31+/m1/s1 |
| InChIKey | JITGKINHLQAZRO-SRZVJSNHSA-N |
| Literature Reference Author | C.I.CHANG,C.R.CHEN,Y.W.LIAO,H.L.CHENG,Y.C.CHEN,C.H.CHOU |
| Literature Reference Citation | J.NAT.PROD.,69,1168(2006) |
| Literature Reference DOI | 10.1021/np068008v |
| Molecular Weight | 472.752 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ15560 |