Chemical identification
Unique IdentifierRID00269
CAS identifier2761-77-5
PubChem identifier6453524
DSSTox identifierDTXSID301317724
Molecular weight 281.355 g/mol
SMILES CN1CCCc2c3C1Cc1ccc(c(c1-c3ccc2)O)O
InChI InChI=1S/C18H19NO2/c1-19-9-3-5-11-4-2-6-13-16(11)14(19)10-12-7-8-15(20)18(21)17(12)13/h2,4,6-8,14,20-21H,3,5,9-10H2,1H3
InChIKey InChIkey=BCNGBNNKPMLIFK-UHFFFAOYSA-N

2D:2D MOL2D MOL22D SDF
3D:3D MOL3D MOL23D SDF3D PDB3D PDBQT

Chemical classification
Kingdom Organic compounds
Superclass Benzenoids
Class Phenanthrenes and derivatives
DISCLAIMER

ReCAnt is a database of chemicals used in aquaculture and their ecotoxic effects, compiled from published literature. The authors are not liable for any inaccuracies or omissions of any chemicals in this resource. Importantly, our sole goal to build this resource on chemicals used in aquaculture is to enable future basic research on this topic, and it does not necessarily reflect the views or objectives of our employers or funders.