| SpectraBase Compound ID | Ey3ZYv0PtL3 |
|---|---|
| InChI | InChI=1S/C39H64O14/c1-17-7-10-39(48-16-17)18(2)28-25(53-39)12-22-20-6-5-19-11-24(23(42)13-38(19,4)21(20)8-9-37(22,28)3)49-36-34(32(46)30(44)27(15-41)51-36)52-35-33(47)31(45)29(43)26(14-40)50-35/h17-36,40-47H,5-16H2,1-4H3/t17-,18-,19+,20?,21?,22?,23-,24+,25?,26-,27-,28?,29-,30+,31+,32+,33-,34-,35+,36-,37-,38-,39+/m0/s1 |
| InChIKey | ZGVRGXGXZKITGK-ZPNHNOODSA-N |
| Mol Weight | 756.9 g/mol |
| Molecular Formula | C39H64O14 |
| Exact Mass | 756.429607 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HPB9qUnHhtx |
|---|---|
| Name | 25(S)-SCHIDIGERA-SAPONIN-F2;25(S)-5-BETA-SPIROSTANE-2-BETA,3-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GALACTOPYRANOSIDE |
| Compound Number | 14S |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H64O14 |
| InChI | InChI=1S/C39H64O14/c1-17-7-10-39(48-16-17)18(2)28-25(53-39)12-22-20-6-5-19-11-24(23(42)13-38(19,4)21(20)8-9-37(22,28)3)49-36-34(32(46)30(44)27(15-41)51-36)52-35-33(47)31(45)29(43)26(14-40)50-35/h17-36,40-47H,5-16H2,1-4H3/t17-,18-,19+,20?,21?,22?,23-,24+,25?,26-,27-,28?,29-,30+,31+,32+,33-,34-,35+,36-,37-,38-,39+/m0/s1 |
| InChIKey | ZGVRGXGXZKITGK-ZPNHNOODSA-N |
| Literature Reference Author | M.MIYAKOSHI,Y.TAMURA,H.MASUDA,K.MIZUTANI,O.TANAKA,T.IKEDA,K. OHTANI,R.KASAI,K.YAM |
| Literature Reference Citation | J.NAT.PROD.,63,332(2000) |
| Literature Reference DOI | 10.1021/np9904354 |
| Molecular Weight | 756.929 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVP7311 |