| SpectraBase Compound ID | 5VeQvkvxOoG |
|---|---|
| InChI | InChI=1S/C42H66O15/c1-20-35(44)28(46-6)14-33(51-20)55-37-22(3)53-34(16-30(37)48-8)56-36-21(2)52-32(15-29(36)47-7)54-27-13-23-9-10-25-24(39(23,4)17-26(27)43)11-12-41-19-50-40(5)38(41)31(18-49-40)57-42(25,41)45/h9,20-22,24-38,43-45H,10-19H2,1-8H3/t20-,21-,22-,24?,25?,26+,27+,28+,29+,30+,31+,32+,33+,34-,35-,36-,37+,38+,39?,40+,41-,42+/m0/s1 |
| InChIKey | SMWZPHWYIHYSMN-VDTFLWHPSA-N |
| Mol Weight | 811.0 g/mol |
| Molecular Formula | C42H66O15 |
| Exact Mass | 810.440171 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Kca2tN4fgWD |
|---|---|
| Name | TYLOPHOSIDE-D;2-ALPHA-HYDROXYHIRUNDIGENIN-3-O-BETA-D-CYMAROPYRANOSYL-(1->4)-ALPHA-L-SARMENTOPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSIDE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H66O15 |
| InChI | InChI=1S/C42H66O15/c1-20-35(44)28(46-6)14-33(51-20)55-37-22(3)53-34(16-30(37)48-8)56-36-21(2)52-32(15-29(36)47-7)54-27-13-23-9-10-25-24(39(23,4)17-26(27)43)11-12-41-19-50-40(5)38(41)31(18-49-40)57-42(25,41)45/h9,20-22,24-38,43-45H,10-19H2,1-8H3/t20-,21-,22-,24?,25?,26+,27+,28+,29+,30+,31+,32+,33+,34-,35-,36-,37+,38+,39?,40+,41-,42+/m0/s1 |
| InChIKey | SMWZPHWYIHYSMN-VDTFLWHPSA-N |
| Literature Reference Author | F.ABE,M.HIROKAWA,T.YAMAUCHI,K.HONDA,N.HAYASHI,R.NISHIDA |
| Literature Reference Citation | CHEM.PHARM.BULL.,47,1384(1999) |
| Literature Reference DOI | 10.1248/cpb.47.1384 |
| Molecular Weight | 810.977 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU8281 |