EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:40151 - 6-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTALENE-2-CARBONYL)-NAPHTALENE-2-CARBOXYLIC ACID

Default Structure
ChEBI IDCHEBI:40151
ChEBI Name6-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTALENE-2-CARBONYL)-NAPHTALENE-2-CARBOXYLIC ACID
Stars
Last Modified17 October 2009
DownloadsMolfile
FormulaC26H26O3
Net Charge0
Average Mass386.491
Monoisotopic Mass386.18819
SMILES[H]OC(=O)c1c([H])c([H])c2c([H])c(C(=O)c3c([H])c([H])c4c(c3[H])C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])C([H])([H])C4(C([H])([H])[H])C([H])([H])[H])c([H])c([H])c2c1[H]
InChIInChI=1S/C26H26O3/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(27)18-7-5-17-14-20(24(28)29)8-6-16(17)13-18/h5-10,13-15H,11-12H2,1-4H3,(H,28,29)
InChIKeyRWYREGSYPCNZTL-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTALENE-2-CARBONYL)-NAPHTALENE-2-CARBOXYLIC ACID (CHEBI:40151) is a unclassifieds (CHEBI:27189)
Synonyms  Source
6-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTALENE-2-CARBONYL)-NAPHTALENE-2-CARBOXYLIC ACIDPDBeChem
6-[(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)carbonyl]naphthalene-2-carboxylic acidPDBeChem
Manual XrefsDatabases
564PDBeChem