SpectraBase Spectrum ID |
DHFCsKOvu8u |
Name |
Methyl 1-O-(3,4-Dichlorophenyl)-2,3,4-tri-O-pivaloyl-.beta.-D-glucopyranuronate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C28H38Cl2O10 |
InChI |
InChI=1S/C28H38Cl2O10/c1-26(2,3)23(32)38-17-18(39-24(33)27(4,5)6)20(40-25(34)28(7,8)9)22(37-19(17)21(31)35-10)36-14-11-12-15(29)16(30)13-14/h11-13,17-20,22H,1-10H3/t17-,18-,19-,20+,22+/m0/s1 |
InChIKey |
UIGCZYMGAQMQEU-YIUJWAEMSA-N |
Literature Reference DOI |
10.1002_1521-4184(200103)334_3_101 |
Molecular Weight |
605.508 g/mol |
SMILES |
c1(cc(Cl)c(cc1)Cl)O[C@]1([C@@]([C@]([C@@]([C@](O1)(C(OC)=O)[H])(OC(C(C)(C)C)=O)[H])(OC(C(C)(C)C)=O)[H])(OC(C(C)(C)C)=O)[H])[H] |
SPLASH |
splash10-0a4i-9110000000-deb40cde51565c366625 |
Source of Spectrum |
APP-334-102-2a |
Synonyms |
(2S,3R,4S,5S,6S)-2-(3,4-dichlorophenoxy)-6-(methoxycarbonyl)tetrahydro-2H-pyran-3,4,5-triyl tris(2,2-dimethylpropanoate) |
Wiley ID |
1770547 |