| SpectraBase Spectrum ID |
4mjJlazd3yu |
| Name |
11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 8-hydroxy-3-methoxy-11-oxo-1-(2-oxopentyl)-6-pentyl- |
| CAS Registry Number |
113706-23-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H28O8 |
| InChI |
InChI=1S/C25H28O8/c1-4-6-7-9-17-22(24(28)29)18(27)13-20-23(17)32-19-12-16(31-3)11-14(10-15(26)8-5-2)21(19)25(30)33-20/h11-13,27H,4-10H2,1-3H3,(H,28,29) |
| InChIKey |
CHJGGBXYLHBLDK-UHFFFAOYSA-N |
| Molecular Weight |
456.491 g/mol |
| SMILES |
OC(c1c(cc2c(c1CCCCC)Oc1c(C(O2)=O)c(cc(c1)OC)CC(=O)CCC)O)=O |
| SPLASH |
splash10-03di-0060900000-6d5421f135ef786d00bc |
| Source of Spectrum |
B-40-2035-4 |
| Synonyms |
8-Hydroxy-3-methoxy-11-oxo-1-(2-oxopentyl)-6-pentyl-11H-dibenzo[b,e][1,4]dioxepin-7-carboxylic acid
Glomelliferonic acid
3-Hydroxy-9-methoxy-6-oxo-7-(2-oxopentyl)-1-pentyl-2-benzo[b][1,4]benzodioxepincarboxylic acid
3-Hydroxy-9-methoxy-6-oxo-7-(2-oxopentyl)-1-pentylbenzo[b][1,4]benzodioxepine-2-carboxylic acid
3-Hydroxy-9-methoxy-6-oxo-7-(2-oxopentyl)-1-pentyl-benzo[b][1,4]benzodioxepine-2-carboxylic acid
9-Methoxy-3-oxidanyl-6-oxidanylidene-7-(2-oxidanylidenepentyl)-1-pentyl-benzo[b][1,4]benzodioxepine-2-carboxylic acid |
| Wiley ID |
1389282 |
