ReCAnt | Resource on Chemicals Used in Aquaculture and Their Ecotoxicity

Moxifoxacin

Moxifoxacin

Biotransformation Network EPA EPISUITE EPA ECOSAR

Biotransformation Network

Hover over the node to see more details.

Successor SMILES	Successor PubChem ID	Reaction Name	Reaction SMILES	Enzyme	Biosystem	Transformation
FC1=C(N2C[C@H]3[C@H](NCCC3)C2)C(=C4N(C5CC5)C=C(C(=O)C4=C1)C(O)=O)O	57370112	EAWAG_RULE_BT0023_PATTERN2		Unspecified environmental bacterial enzyme	ENVMICRO (Biotransformer3 )
FC1=C(N2C[C@H]3[C@H](NCCC3)C2)C(OC)=C4NC=C(C(=O)C4=C1)C(O)=O		EAWAG_RULE_BT0063_PATTERN2		Unspecified environmental bacterial enzyme	ENVMICRO (Biotransformer3 )
C1(CC1)=O	138404	EAWAG_RULE_BT0063_PATTERN2		Unspecified environmental bacterial enzyme	ENVMICRO (Biotransformer3 )
FC1=C(NC[C@@H]2[C@H](C=O)CCCN2)C(OC)=C3N(C4CC4)C=C(C(=O)C3=C1)C(O)=O		EAWAG_RULE_BT0063_PATTERN2		Unspecified environmental bacterial enzyme	ENVMICRO (Biotransformer3 )
FC1=C(N2C[C@@H](C(C2)=O)CCCN)C(OC)=C3N(C4CC4)C=C(C(=O)C3=C1)C(O)=O		EAWAG_RULE_BT0063_PATTERN2		Unspecified environmental bacterial enzyme	ENVMICRO (Biotransformer3 )
FC1=C(N2C[C@@H]([C@H](N)C2)CCC=O)C(OC)=C3N(C4CC4)C=C(C(=O)C3=C1)C(O)=O		EAWAG_RULE_BT0063_PATTERN2		Unspecified environmental bacterial enzyme	ENVMICRO (Biotransformer3 )
FC1=C(NC[C@H]2[C@H](NCCC2)C=O)C(OC)=C3N(C4CC4)C=C(C(=O)C3=C1)C(O)=O		EAWAG_RULE_BT0063_PATTERN2		Unspecified environmental bacterial enzyme	ENVMICRO (Biotransformer3 )
FC1=C(N2CC3([C@H](NCCC3)C2)O)C(OC)=C4N(C5CC5)C=C(C(=O)C4=C1)C(O)=O		EAWAG_RULE_BT0241		Unspecified environmental bacterial enzyme	ENVMICRO (Biotransformer3 )

↑ Back to Top

EPA EPISUITE – Environmental Fate

Predicted log KOW ⓘ	Experimental log KOW ⓘ	Predicted log KAW ⓘ	Predicted log KOA ⓘ	Experimental log KOA ⓘ	BCF (L/kg wet-wt) ⓘ	BAF (L/kg wet-wt) ⓘ
0.9519	0.95	-17.8958	18.8458		3.16	1.65

↑ Back to Top

EPA ECOSAR – Aquatic Toxicity

QSAR Class	Organism	Duration	Endpoint	Concentration (mg/L)
Aliphatic Amines	Fish	96-hr	LC50	3775.4785
Aliphatic Amines	Daphnid	48-hr	LC50	398.3336
Aliphatic Amines	Green Algae	96-hr	EC50	418.4485
Neutral Organics	Fish	96-hr	LC50	28921.9102
Neutral Organics	Daphnid	48-hr	LC50	14904.6543
Neutral Organics	Green Algae	96-hr	EC50	7435.873
Neutral Organics	Fish (SW)	96-hr	LC50	36182.3672
Neutral Organics	Mysid	96-hr	LC50	54765.4766
Vinyl/Allyl Propargyl Ketones	Fish	96-hr	LC50	6204.9312
Vinyl/Allyl Propargyl Ketones	Daphnid	48-hr	LC50	4186.1226
Vinyl/Allyl Propargyl Ketones	Green Algae	96-hr	EC50	13124.1709
Vinyl/Allyl Propargyl Ketones	Fish (SW)	96-hr	LC50	531351.375
Vinyl/Allyl Propargyl Ketones	Mysid (SW)	96-hr	LC50	26551.0625

↑ Back to Top

⇧

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.