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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Administrative data

Endpoint:
short-term toxicity to fish
Type of information:
(Q)SAR
Adequacy of study:
weight of evidence
Reliability:
4 (not assignable)
Rationale for reliability incl. deficiencies:
results derived from a valid (Q)SAR model and falling into its applicability domain, with limited documentation / justification
Justification for type of information:
QSAR prediction: migrated from IUCLID 5.6

Data source

Referenceopen allclose all

Reference Type:
other: Predicted data
Title:
No information
Author:
Gedeon Richter Plc. Health and Safety Department
Year:
2015
Bibliographic source:
QSAR Toolbox 3.1.0.21
Reference Type:
other: Predicted data
Title:
No information
Author:
Gedeon Richter Plc. Health and Safety Department
Year:
2015
Bibliographic source:
VegaNIC - Vega Non - Interactive Client - version 1.0.8
Reference Type:
other: Predicted data
Title:
No information
Author:
Gedeon Richter Plc. Health and Safety Department
Year:
2015
Bibliographic source:
T.E.S.T. version 4.1
Reference Type:
other: Predicted data
Title:
No information
Author:
Gedeon Richter Plc. Health and Safety Department
Year:
2015
Bibliographic source:
ChemProp - QSAR 6 Public OSIRIS Edition

Materials and methods

Test guideline
Guideline:
other: REACH guidance on QSARs R.6, May/July2008
GLP compliance:
not specified

Test material

Constituent 1
Chemical structure
Reference substance name:
13-ethyl-3-methoxygona-2,5(10)-dien-17β-ol
EC Number:
238-513-9
EC Name:
13-ethyl-3-methoxygona-2,5(10)-dien-17β-ol
Cas Number:
14507-49-4
Molecular formula:
C20H30O2
IUPAC Name:
(1S,3aS,3bR,9bS,11aS)-11a-ethyl-7-methoxy-1H,2H,3H,3aH,3bH,4H,5H,6H,9H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-ol

Results and discussion

Effect concentrations
Duration:
96 h
Dose descriptor:
LC50
Effect conc.:
0.39 mg/L
Nominal / measured:
estimated

Any other information on results incl. tables

Sublethal observations / clinical signs:

Software Database / Method Endpoint Test duration Species Predicted value
QSAR Toolbox Aquatic OASIS LC50 96 h Pimephales promales 0.739 mg/l
VegaNIC N.A. LC50 96 h Fathead minnow 0.58 mg/l
T.E.S.T. Consensus method LC50 96 h Fathead minnow 0.49 mg/l
T.E.S.T. Hiearchical Clustering Method LC50 96 h Fathead minnow 0.48 mg/l
T.E.S.T. Group Contribution Method LC50 96 h Fathead minnow 0.3 mg/l
T.E.S.T. FDA method LC50 96 h Fathead minnow 0.11 mg/l
ChemProp Martin and Young model LC50 96 h Fathead minnow 0.04 mg/l
Inferental result         0.39 mg/l

Applicant's summary and conclusion

Conclusions:
According to (Q)SAR modells: QSAR Toolbox, VegaNIC, T.E.S.T., ChemProp the predicted values indicated that gonol is hazardous to fishes. The result meets the requirement of Aquatic Acute Category 1.