| SpectraBase Compound ID | 4WCUHJZ9UBH |
|---|---|
| InChI | InChI=1S/C39H64O13/c1-18-7-12-39(47-17-18)19(2)28-25(52-39)14-24-22-6-5-20-13-21(8-10-37(20,3)23(22)9-11-38(24,28)4)48-35-33(46)31(44)34(27(16-41)50-35)51-36-32(45)30(43)29(42)26(15-40)49-36/h18-36,40-46H,5-17H2,1-4H3/t18-,19+,20-,21+,22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33-,34+,35-,36-,37+,38+,39-/m1/s1 |
| InChIKey | GUSVHVVOABZHAH-MMWWXJNXSA-N |
| Mol Weight | 740.9 g/mol |
| Molecular Formula | C39H64O13 |
| Exact Mass | 740.434692 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4WT4Q1ZM8fg |
|---|---|
| Name | (25-R)-5-BETA-SPIROSTAN-3-BETA-YL-O-BETA-GLUCOPYRANOSYL-(1->4)-BETA-D-GALACTOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H64O13 |
| InChI | InChI=1S/C39H64O13/c1-18-7-12-39(47-17-18)19(2)28-25(52-39)14-24-22-6-5-20-13-21(8-10-37(20,3)23(22)9-11-38(24,28)4)48-35-33(46)31(44)34(27(16-41)50-35)51-36-32(45)30(43)29(42)26(15-40)49-36/h18-36,40-46H,5-17H2,1-4H3/t18-,19+,20-,21+,22-,23+,24+,25+,26+,27-,28+,29+,30-,31-,32+,33-,34+,35-,36-,37+,38+,39-/m1/s1 |
| InChIKey | GUSVHVVOABZHAH-MMWWXJNXSA-N |
| Literature Reference Author | A.YOKOSUKA,M.JITSUNO,S.YUI,M.YAMAZAKI,Y.MIMAKI |
| Literature Reference Citation | J.NAT.PROD.,72,1399(2009) |
| Literature Reference DOI | 10.1021/np900168d |
| Molecular Weight | 740.929 g/mol |
| Sample ID | 33300 |
| Solvent | C5D5N |