| SpectraBase Compound ID | 5LiCMzNeQHZ |
|---|---|
| InChI | InChI=1S/C40H56O22/c1-18(2)11-40(62-38-35(53)32(50)29(47)25(15-43)61-38,39(54)56-17-20-5-9-22(10-6-20)58-37-34(52)31(49)28(46)24(14-42)60-37)12-26(44)55-16-19-3-7-21(8-4-19)57-36-33(51)30(48)27(45)23(13-41)59-36/h3-10,18,23-25,27-38,41-43,45-53H,11-17H2,1-2H3/t23-,24+,25-,27-,28+,29-,30+,31-,32+,33-,34+,35-,36-,37+,38+,40+/m0/s1 |
| InChIKey | QUCKZYFUROTIBC-BLBAJWMGSA-N |
| Mol Weight | 888.9 g/mol |
| Molecular Formula | C40H56O22 |
| Exact Mass | 888.326323 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JYxFtPTjZUK |
|---|---|
| Name | DACTYLORHIN-A;(2R)-2-BETA-D-GLUCOPYRANOSYLOXY-2-(2-METHYLPROPYL)-BUTANEDIOIC-ACID-BIS-(4-BETA-D-GLUCOPYRANOSYLOXYBENZYL)-ESTER |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H56O22 |
| InChI | InChI=1S/C40H56O22/c1-18(2)11-40(62-38-35(53)32(50)29(47)25(15-43)61-38,39(54)56-17-20-5-9-22(10-6-20)58-37-34(52)31(49)28(46)24(14-42)60-37)12-26(44)55-16-19-3-7-21(8-4-19)57-36-33(51)30(48)27(45)23(13-41)59-36/h3-10,18,23-25,27-38,41-43,45-53H,11-17H2,1-2H3/t23-,24+,25-,27-,28+,29-,30+,31-,32+,33-,34+,35-,36-,37+,38+,40+/m0/s1 |
| InChIKey | QUCKZYFUROTIBC-BLBAJWMGSA-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 | 888.871 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU8422 |