| SpectraBase Compound ID | 6CAqwhzqOld |
|---|---|
| InChI | InChI=1S/C29H38O11/c1-3-4-9-37-10-5-6-16-11-18-19(15-38-29-26(35)25(34)24(33)23(14-30)39-29)27(40-28(18)21(32)12-16)17-7-8-20(31)22(13-17)36-2/h5-8,11-13,19,23-27,29-35H,3-4,9-10,14-15H2,1-2H3/b6-5+/t19-,23-,24-,25+,26-,27+,29-/m1/s1 |
| InChIKey | QJHORNPMBBCWTM-KXUJZNGHSA-N |
| Mol Weight | 562.6 g/mol |
| Molecular Formula | C29H38O11 |
| Exact Mass | 562.241412 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BVnuplV5Tw3 |
|---|---|
| Name | 9'-O-BUTYL-3-O-DEMETHYL-9-O-BETA-D-GLUCOPYRANOSYLDEHYDROCONIFERYL_ALCOHOL |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H38O11 |
| InChI | InChI=1S/C29H38O11/c1-3-4-9-37-10-5-6-16-11-18-19(15-38-29-26(35)25(34)24(33)23(14-30)39-29)27(40-28(18)21(32)12-16)17-7-8-20(31)22(13-17)36-2/h5-8,11-13,19,23-27,29-35H,3-4,9-10,14-15H2,1-2H3/b6-5+/t19-,23-,24-,25+,26-,27+,29-/m1/s1 |
| InChIKey | QJHORNPMBBCWTM-KXUJZNGHSA-N |
| Literature Reference Author | J.J.ARAYA,K.KINDSCHER,B.N.TIMMERMANN |
| Literature Reference Citation | J.NAT.PROD.,75,400(2012) |
| Literature Reference DOI | 10.1021/np2008076 |
| Molecular Weight | 562.614 g/mol |
| Sample ID | 40145 |
| Solvent | C5D5N |