![16(S)-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[BETA-D-GALACTOPYRANOSYL-(1->3)]-BETA-D-GLUCOPYRANOSYLOXY]-PREGNA-4,17(20)-Z-DIEN-3-ONE](/api/spectrum/oVc1aEoNhH/structure.png?h=300&w=458 "16(S)-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[BETA-D-GALACTOPYRANOSYL-(1->3)]-BETA-D-GLUCOPYRANOSYLOXY]-PREGNA-4,17(20)-Z-DIEN-3-ONE")
| SpectraBase Compound ID | La26npUxPcB |
|---|---|
| InChI | InChI=1S/C39H60O16/c1-5-20-23(13-22-19-7-6-17-12-18(42)8-10-38(17,3)21(19)9-11-39(20,22)4)51-37-34(55-35-31(48)29(46)26(43)16(2)50-35)33(28(45)25(15-41)53-37)54-36-32(49)30(47)27(44)24(14-40)52-36/h5,12,16,19,21-37,40-41,43-49H,6-11,13-15H2,1-4H3/b20-5+/t16-,19?,21?,22?,23-,24+,25+,26-,27+,28+,29+,30-,31+,32+,33-,34+,35-,36-,37+,38-,39+/m0/s1 |
| InChIKey | BGQDUIOTKONDFO-DHEMPABASA-N |
| Mol Weight | 784.9 g/mol |
| Molecular Formula | C39H60O16 |
| Exact Mass | 784.388136 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | oVc1aEoNhH |
|---|---|
| Name | 16(S)-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[BETA-D-GALACTOPYRANOSYL-(1->3)]-BETA-D-GLUCOPYRANOSYLOXY]-PREGNA-4,17(20)-Z-DIEN-3-ONE |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H60O16 |
| InChI | InChI=1S/C39H60O16/c1-5-20-23(13-22-19-7-6-17-12-18(42)8-10-38(17,3)21(19)9-11-39(20,22)4)51-37-34(55-35-31(48)29(46)26(43)16(2)50-35)33(28(45)25(15-41)53-37)54-36-32(49)30(47)27(44)24(14-40)52-36/h5,12,16,19,21-37,40-41,43-49H,6-11,13-15H2,1-4H3/b20-5+/t16-,19?,21?,22?,23-,24+,25+,26-,27+,28+,29+,30-,31+,32+,33-,34+,35-,36-,37+,38-,39+/m0/s1 |
| InChIKey | BGQDUIOTKONDFO-DHEMPABASA-N |
| Literature Reference Author | H.ACHENBACH,H.HUEBNER,M.REITER |
| Literature Reference Citation | PHYTOCHEM.,41,907(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00622-2 |
| Molecular Weight | 784.896 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU4141 |