| SpectraBase Compound ID | IeOiYTrkz32 |
|---|---|
| InChI | InChI=1S/C38H54O13/c1-18(40)51-33(2,3)13-12-25(42)38(9,48)30-21(41)15-35(6)24-11-10-19-20(37(24,8)26(43)16-36(30,35)7)14-22(31(47)34(19,4)5)49-32-29(46)28(45)27(44)23(17-39)50-32/h10,12-14,20-21,23-24,27-30,32,39,41,44-46,48H,11,15-17H2,1-9H3/b13-12+/t20?,21-,23-,24?,27-,28+,29-,30?,32-,35+,36-,37+,38+/m0/s1 |
| InChIKey | QKEJRKXVLGOJMB-IXTQRKHBSA-N |
| Mol Weight | 718.8 g/mol |
| Molecular Formula | C38H54O13 |
| Exact Mass | 718.356442 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4huMxFrdjxY |
|---|---|
| Name | 2-O-beta-D-GLUCOPYRANOSYL CUCURBITACIN E |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C38H54O13 |
| InChI | InChI=1S/C38H54O13/c1-18(40)51-33(2,3)13-12-25(42)38(9,48)30-21(41)15-35(6)24-11-10-19-20(37(24,8)26(43)16-36(30,35)7)14-22(31(47)34(19,4)5)49-32-29(46)28(45)27(44)23(17-39)50-32/h10,12-14,20-21,23-24,27-30,32,39,41,44-46,48H,11,15-17H2,1-9H3/b13-12+/t20?,21-,23-,24?,27-,28+,29-,30?,32-,35+,36-,37+,38+/m0/s1 |
| InChIKey | QKEJRKXVLGOJMB-IXTQRKHBSA-N |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |