| SpectraBase Compound ID | LZXQag402pM |
|---|---|
| InChI | InChI=1S/C27H40O17/c1-11(2)7-27(22(36)23(37)38,44-25-21(35)19(33)17(31)15(9-29)43-25)26(39)40-10-12-3-5-13(6-4-12)41-24-20(34)18(32)16(30)14(8-28)42-24/h3-6,11,14-22,24-25,28-36H,7-10H2,1-2H3,(H,37,38)/t14-,15+,16-,17+,18+,19-,20-,21+,22+,24-,25-,27-/m1/s1 |
| InChIKey | WBSSVHBTDKPYQF-YETUWRBRSA-N |
| Mol Weight | 636.6 g/mol |
| Molecular Formula | C27H40O17 |
| Exact Mass | 636.22655 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4MldEPAn6r1 |
|---|---|
| Name | DACTYLORHIN-D;(2R,3S)-2-BETA-D-GLUCOPYRANOSYLOXY-3-HYDROXY-2-(2-METHYLPROPYL)-BUTANEDIOIC-ACID-1-(4-BETA-D-GLUCOPYRANOSYLOXYBENZYL)-ESTER |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H40O17 |
| InChI | InChI=1S/C27H40O17/c1-11(2)7-27(22(36)23(37)38,44-25-21(35)19(33)17(31)15(9-29)43-25)26(39)40-10-12-3-5-13(6-4-12)41-24-20(34)18(32)16(30)14(8-28)42-24/h3-6,11,14-22,24-25,28-36H,7-10H2,1-2H3,(H,37,38)/t14-,15+,16-,17+,18+,19-,20-,21+,22+,24-,25-,27-/m1/s1 |
| InChIKey | WBSSVHBTDKPYQF-YETUWRBRSA-N |
| Literature Reference Author | H.KIZU,E.I.KANEKO,T.TOMIMORI |
| Literature Reference Citation | CHEM.PHARM.BULL.,47,1618(1999) |
| Literature Reference DOI | 10.1248/cpb.47.1618 |
| Molecular Weight | 636.604 g/mol |
| Solvent | D2O |
| Source File Reference | UWLU8426 |