3,7,11-tris(9H-tribenzo[b,d,f]azepin-9-yl)quinolino[3,2,1-de]acridine-5,9-dione

This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
InChI descriptor[cheminf_000113]: InChI=1S/C74H44N4O2/c79-73-60-41-45(75-64-31-13-7-25-54(64)48-19-1-2-20-49(48)55-26-8-14-32-65(55)75)37-39-70(60)78-71-40-38-46(76-66-33-15-9-27-56(66)50-21-3-4-22-51(50)57-28-10-16-34-67(57)76)42-61(71)74(80)63-44-47(43-62(73)72(63)78)77-68-35-17-11-29-58(68)52-23-5-6-24-53(52)59-30-12-18-36-69(59)77/h1-44H, and canonical SMILES descriptor[cheminf_000007]: O=c1c2cc(ccc2n2c3c1cc(cc3c(=O)c1c2ccc(c1)N1c2ccccc2-c2c(-c3c1cccc3)cccc2)N1c2ccccc2-c2c(-c3c1cccc3)cccc2)N1c2ccccc2-c2c(-c3c1cccc3)cccc2, and by the IUPAC name[cheminf_000107]: .

The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:

The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-55837

The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
Melting point descriptor[CHEMINF_000256]:
Boiling point descriptor[CHEMINF_000257]:
Refractive index descriptor[CHEMINF_000253]:

The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:

CHMO:0000593 | 1H nuclear magnetic resonance spectroscopy (1H NMR)

CHMO:0001150 | 1H--1H correlation spectroscopy (1H-1H COSY)

CHMO:0001146 | 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

CHMO:0001148 | 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)

CHMO:0000595 | 13C nuclear magnetic resonance spectroscopy (13C NMR)

CHMO:0000630 | infrared absorption spectroscopy (IR)

CHMO:0000292 | ultraviolet-visible spectrophotometry (UV-VIS)

CHMO:0000470 | mass spectrometry (MS)

The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID:

Used ontologies:
CHEBI - Chemical Entities of Biological Interest
CHEMINF - chemical information ontology (information entities about chemical entities)
CHMO - Chemical Methods Ontology
OBI - Ontology for Biomedical Investigations