| SpectraBase Compound ID | 9u1aqK2lfZO |
|---|---|
| InChI | InChI=1S/C27H44O8/c1-13(29)21-19(30)11-18-16-5-4-14-10-15(6-8-26(14,2)17(16)7-9-27(18,21)3)34-25-24(33)23(32)22(31)20(12-28)35-25/h4,13,15-25,28-33H,5-12H2,1-3H3/t13-,15+,16?,17?,18?,19+,20-,21?,22-,23+,24-,25-,26+,27+/m1/s1 |
| InChIKey | MMAFNNBLJJXUCU-VGBJKXOXSA-N |
| Mol Weight | 496.6 g/mol |
| Molecular Formula | C27H44O8 |
| Exact Mass | 496.303618 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7WzuiAMSjc3 |
|---|---|
| Name | PREGN-5-ENE-3-BETA,16-BETA,20R-TRIOL-3-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H44O8 |
| InChI | InChI=1S/C27H44O8/c1-13(29)21-19(30)11-18-16-5-4-14-10-15(6-8-26(14,2)17(16)7-9-27(18,21)3)34-25-24(33)23(32)22(31)20(12-28)35-25/h4,13,15-25,28-33H,5-12H2,1-3H3/t13-,15+,16?,17?,18?,19+,20-,21?,22-,23+,24-,25-,26+,27+/m1/s1 |
| InChIKey | MMAFNNBLJJXUCU-VGBJKXOXSA-N |
| Literature Reference Author | M.S.KAMEL,A.KOSKINEN |
| Literature Reference Citation | PHYTOCHEM.,40,1773(1995) |
| Literature Reference DOI | 10.1016/0031-9422(95)00551-H |
| Molecular Weight | 496.642 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU4594 |