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CHEBI:51783 - ATTO 425-2

ChEBI IDCHEBI:51783
ChEBI NameATTO 425-2
Stars
Last Modified19 December 2017
SubmitterInma Spiteri
DownloadsMolfile
FormulaC22H27NO6
Net Charge0
Average Mass401.459
Monoisotopic Mass401.18384
SMILESCCOC(=O)c1cc2cc3c(cc2oc1=O)N(CCCC(=O)O)C(C)(C)CC3C
InChIInChI=1S/C22H27NO6/c1-5-28-20(26)16-10-14-9-15-13(2)12-22(3,4)23(8-6-7-19(24)25)17(15)11-18(14)29-21(16)27/h9-11,13H,5-8,12H2,1-4H3,(H,24,25)
InChIKeyWNDDWSAHNYBXKY-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Application:
fluorochrome  A fluorescent dye used to stain biological specimens.
ChEBI Ontology
Outgoing Relation(s)
ATTO 425-2 (CHEBI:51783) has role fluorochrome (CHEBI:51217)
ATTO 425-2 (CHEBI:51783) is a 7-aminocoumarins (CHEBI:51769)
ATTO 425-2 (CHEBI:51783) is a dicarboxylic acid monoester (CHEBI:36244)
ATTO 425-2 (CHEBI:51783) is a ethyl ester (CHEBI:23990)
ATTO 425-2 (CHEBI:51783) is a organic heterotricyclic compound (CHEBI:26979)
Incoming Relation(s)
ATTO 425-3 (CHEBI:51784) has functional parent ATTO 425-2 (CHEBI:51783)
ATTO 425-4 (CHEBI:51785) has functional parent ATTO 425-2 (CHEBI:51783)
ATTO 425-7 (CHEBI:51786) has functional parent ATTO 425-2 (CHEBI:51783)
IUPAC Name 
4-[3-(ethoxycarbonyl)-6,8,8-trimethyl-2-oxo-7,8-dihydro-2H-pyrano[3,2-g]quinolin-9(6H)-yl]butanoic acid
Synonym  Source
ATTO 425 free acidChEBI