CHEBI:52796 - ATTO 565 meta-isomer(1+)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name ATTO 565 meta-isomer(1+)
ChEBI ID CHEBI:52796
ChEBI ASCII Name ATTO 565 meta-isomer(1+)
Definition The meta-isomer of ATTO 565 cation.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C31H31N2O5
Net Charge +1
Average Mass 511.58820
Monoisotopic Mass 511.22275
InChI InChI=1S/C31H30N2O5/c1-3-32-11-5-7-18-13-23-27(16-25(18)32)38-28-17-26-19(8-6-12-33(26)4-2)14-24(28)29(23)21-10-9-20(30(34)35)15-22(21)31(36)37/h9-10,13-17H,3-8,11-12H2,1-2H3,(H-,34,35,36,37)/p+1
InChIKey JSUSGWOUEVOMBB-UHFFFAOYSA-O
SMILES CCN1CCCc2cc3c(Oc4cc5=[N+](CC)CCCc5cc4=C3c3ccc(cc3C(O)=O)C(O)=O)cc12
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Application(s): fluorochrome
A fluorescent dye used to stain biological specimens.
dye

(via xanthene dye )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing ATTO 565 meta-isomer(1+) (CHEBI:52796) has role fluorochrome (CHEBI:51217)
ATTO 565 meta-isomer(1+) (CHEBI:52796) is a dicarboxylic acid (CHEBI:35692)
ATTO 565 meta-isomer(1+) (CHEBI:52796) is a organic heteropentacyclic compound (CHEBI:38164)
ATTO 565 meta-isomer(1+) (CHEBI:52796) is a xanthene dye (CHEBI:37929)
Incoming ATTO 565 meta-isomer (CHEBI:51816) has part ATTO 565 meta-isomer(1+) (CHEBI:52796)
IUPAC Name
6-(2,4-dicarboxyphenyl)-1,11-diethyl-3,4,8,9,10,11-hexahydro-2H-pyrano[3,2-g:5,6-g']diquinolin-1-ium
Last Modified
27 August 2009