![3-BETA-[(ALPHA-L-ARABINOPYRANOSYL)-OXY]-URS-12,19(29)-DIEN-28-OIC-ACID-28-BETA-D-GLUCOPYRANOSYLESTER](/api/spectrum/J2GDRElzVhJ/structure.png?h=300&w=458 "3-BETA-[(ALPHA-L-ARABINOPYRANOSYL)-OXY]-URS-12,19(29)-DIEN-28-OIC-ACID-28-BETA-D-GLUCOPYRANOSYLESTER")
| SpectraBase Compound ID | 7OPtmGrb6GM |
|---|---|
| InChI | InChI=1S/C41H64O12/c1-20-10-15-41(36(49)53-35-33(48)31(46)30(45)24(18-42)51-35)17-16-39(6)22(28(41)21(20)2)8-9-26-38(5)13-12-27(37(3,4)25(38)11-14-40(26,39)7)52-34-32(47)29(44)23(43)19-50-34/h8,20,23-35,42-48H,2,9-19H2,1,3-7H3/t20-,23+,24-,25+,26-,27+,28+,29+,30-,31+,32-,33-,34+,35+,38+,39-,40-,41+/m1/s1 |
| InChIKey | TXWFEKCXGJREKU-LWQGPOSASA-N |
| Mol Weight | 749.0 g/mol |
| Molecular Formula | C41H64O12 |
| Exact Mass | 748.439777 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J2GDRElzVhJ |
|---|---|
| Name | 3-BETA-[(ALPHA-L-ARABINOPYRANOSYL)-OXY]-URS-12,19(29)-DIEN-28-OIC-ACID-28-BETA-D-GLUCOPYRANOSYLESTER |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H64O12 |
| InChI | InChI=1S/C41H64O12/c1-20-10-15-41(36(49)53-35-33(48)31(46)30(45)24(18-42)51-35)17-16-39(6)22(28(41)21(20)2)8-9-26-38(5)13-12-27(37(3,4)25(38)11-14-40(26,39)7)52-34-32(47)29(44)23(43)19-50-34/h8,20,23-35,42-48H,2,9-19H2,1,3-7H3/t20-,23+,24-,25+,26-,27+,28+,29+,30-,31+,32-,33-,34+,35+,38+,39-,40-,41+/m1/s1 |
| InChIKey | TXWFEKCXGJREKU-LWQGPOSASA-N |
| Literature Reference Author | Y.MIMAKI,M.FUKUSHIMA,A.YOKOSUKA,Y.SASHIDA,S.FURUYA,H.SAKAGAM I |
| Literature Reference Citation | PHYTOCHEM.,57,773(2001) |
| Literature Reference DOI | 10.1016/S0031-9422(01)00083-8 |
| Molecular Weight | 748.952 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN2347 |