SpectraBase Spectrum ID |
9ypHhDCzmJW |
Name |
6H-Cyclohepta[b]furan-5-carboxylic acid, 7,8-dihydro-4-hydroxy-3,6-dimethyl-8-oxo-7-(2-oxobutyl)-, methyl ester, trans-(.+-.)- |
CAS Registry Number |
112358-97-1 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H20O6 |
InChI |
InChI=1S/C17H20O6/c1-5-10(18)6-11-9(3)13(17(21)22-4)15(20)12-8(2)7-23-16(12)14(11)19/h7,9,11,20H,5-6H2,1-4H3/t9-,11-/m1/s1 |
InChIKey |
BIQQQCJMKASILV-MWLCHTKSSA-N |
Molecular Weight |
320.341 g/mol |
SMILES |
OC=1c2c(occ2C)C([C@@]([C@](C1C(=O)OC)(C)[H])(CC(=O)CC)[H])=O |
SPLASH |
splash10-066r-3390000000-7f5728e2e8736700ab37 |
Source of Spectrum |
KC-1990-1609-48 |
Synonyms |
Methyl (6R,7R)-4-hydroxy-3,6-dimethyl-8-oxo-7-(2-oxobutyl)-7,8-dihydro-6H-cyclohepta[b]furan-5-carboxylate
Methyl trans-4-hydroxy-3,6-dimethyl-8-oxo-7-(2-oxobutyl)-7,8-dihydro-6H-cyclohepta[b]furan-5-carboxylate |
Wiley ID |
1320023 |