| SpectraBase Spectrum ID |
90gepTXBB6K |
| Name |
1-Phenyl-2-hydroxy-3,7-dimethyl-11-aldehydictetradecane-2-beta-D-glucopyranoside |
| Alternate Name(s) |
6,10-dimethyl-12-phenyl-2-propyl-11-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)dodecanal |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H48O7 |
| InChI |
InChI=1S/C29H48O7/c1-4-10-23(18-30)16-9-12-20(2)11-8-13-21(3)24(17-22-14-6-5-7-15-22)35-29-28(34)27(33)26(32)25(19-31)36-29/h5-7,14-15,18,20-21,23-29,31-34H,4,8-13,16-17,19H2,1-3H3/t20?,21?,23?,24?,25-,26-,27+,28-,29-/m1/s1 |
| InChIKey |
JRGIDSOJTNMGIC-GPBVNURBSA-N |
| Literature Reference DOI |
10.1002/pca.879 |
| Molecular Weight |
508.696 g/mol |
| SMILES |
OC[C@@]1([C@]([C@@]([C@]([C@@](O1)(OC(Cc1ccccc1)C(CCCC(CCCC(CCC)C=O)C)C)[H])(O)[H])(O)[H])(O)[H])[H] |
| SPLASH |
splash10-0aba-3942000000-312d0de947ab6b37f100 |
| Source of Spectrum |
PA-17-39-4 |
| Wiley ID |
1789523 |
