| SpectraBase Compound ID | HC35828sDAn |
|---|---|
| InChI | InChI=1S/C39H64O16/c1-15(40)25-23(41)13-22-20-7-6-18-12-19(8-10-38(18,4)21(20)9-11-39(22,25)5)53-37-34(55-36-33(49)30(46)27(43)17(3)52-36)31(47)28(44)24(54-37)14-50-35-32(48)29(45)26(42)16(2)51-35/h6,15-17,19-37,40-49H,7-14H2,1-5H3/t15-,16+,17+,19+,20?,21?,22?,23+,24-,25?,26+,27+,28-,29-,30-,31+,32-,33-,34-,35-,36+,37-,38+,39+/m1/s1 |
| InChIKey | DHEBGTQGALZORI-ZZODKLFNSA-N |
| Mol Weight | 788.9 g/mol |
| Molecular Formula | C39H64O16 |
| Exact Mass | 788.419436 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Lx3gBuoOdyz |
|---|---|
| Name | BALAGYPTIN;PREGN-5-ENE-3-BETA,16-BETA,20R-TRIOL-3-O-(2,6-DI-O-ALPHA-L-RHAMNOPYRANOSYL)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H64O16 |
| InChI | InChI=1S/C39H64O16/c1-15(40)25-23(41)13-22-20-7-6-18-12-19(8-10-38(18,4)21(20)9-11-39(22,25)5)53-37-34(55-36-33(49)30(46)27(43)17(3)52-36)31(47)28(44)24(54-37)14-50-35-32(48)29(45)26(42)16(2)51-35/h6,15-17,19-37,40-49H,7-14H2,1-5H3/t15-,16+,17+,19+,20?,21?,22?,23+,24-,25?,26+,27+,28-,29-,30-,31+,32-,33-,34-,35-,36+,37-,38+,39+/m1/s1 |
| InChIKey | DHEBGTQGALZORI-ZZODKLFNSA-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 | 788.928 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU4592 |