| SpectraBase Spectrum ID |
LxVNqUjG2ik |
| Name |
(7'S,8S,8'R)-3,3',4,4'-bis(Methylenedioxy)-8'-[(3'',5''-dinitrobenzoyloxy)methyl]lignano-9,7'-lactone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H20N2O12 |
| InChI |
InChI=1S/C27H20N2O12/c30-26(16-7-17(28(32)33)10-18(8-16)29(34)35)36-11-20-19(5-14-1-3-21-23(6-14)39-12-37-21)27(31)41-25(20)15-2-4-22-24(9-15)40-13-38-22/h1-4,6-10,19-20,25H,5,11-13H2/t19-,20-,25+/m0/s1 |
| InChIKey |
MJGWVQBIVKKJLZ-ZYLNGJIFSA-N |
| Molecular Weight |
564.459 g/mol |
| SMILES |
C1(O[C@@]([C@]([C@@]1(Cc1cc2c(OCO2)cc1)[H])(COC(c1cc(N(=O)=O)cc(N(=O)=O)c1)=O)[H])(c1cc2OCOc2cc1)[H])=O |
| SPLASH |
splash10-0076-0907040000-0151eeb867624b76ca6d |
| Source of Spectrum |
F5-6-2626-8a |
| Synonyms |
((2S,3R,4S)-2-(benzo[d][1,3]dioxol-5-yl)-4-(benzo[d][1,3]dioxol-5-ylmethyl)-5-oxotetrahydrofuran-3-yl)methyl 3,5-dinitrobenzoate |
| Wiley ID |
1733465 |
![(7'S,8S,8'R)-3,3',4,4'-bis(Methylenedioxy)-8'-[(3'',5''-dinitrobenzoyloxy)methyl]lignano-9,7'-lactone](/api/spectrum/LxVNqUjG2ik/structure.png?h=300&w=458 "(7'S,8S,8'R)-3,3',4,4'-bis(Methylenedioxy)-8'-[(3'',5''-dinitrobenzoyloxy)methyl]lignano-9,7'-lactone")
