TOPKAT (toxicity prediction) analysis of compounds (1–10) isolated from the ethyl acetate extract of Aspergillus sp. obtained from the soft coral Sinularia speciesa.
Compounds | Ames prediction | Rat oral LD50 | Rat chronic LOAEL | Skin irritancy | Ocular irritancy | Rat female NTP | Rat male NTP |
---|---|---|---|---|---|---|---|
1 | Non-mutagen | 0.16 | 0.0038 | Mild | None | Non-carcinogen | Carcinogen |
2 | Non-mutagen | 0.29 | 0.0033 | Mild | None | Non-carcinogen | Carcinogen |
3 | Non-mutagen | 1.14 | 0.0043 | Mild | Mild | Non-carcinogen | Non-carcinogen |
4 | Non-mutagen | 1.43 | 0.0026 | Mild | Mild | Non-carcinogen | Non-carcinogen |
5 | Non-mutagen | 1.34 | 0.0036 | Mild | Mild | Non-carcinogen | Non-carcinogen |
6 | Non-mutagen | 0.82 | 0.0145 | None | Moderate | Non-carcinogen | Carcinogen |
7 | Non-mutagen | 0.89 | 0.0076 | Mild | Moderate | Non-carcinogen | Carcinogen |
8 | Non-mutagen | 0.56 | 0.0218 | None | Moderate | Non-carcinogen | Carcinogen |
9 | Non-mutagen | 9.68 | 0.9891 | Mild | None | Carcinogen | Non-carcinogen |
10 | Non-mutagen | 4.05 | 1.6549 | None | Moderate | Carcinogen | Non-carcinogen |
Both rat oral LD5 and rat chronic LOAEL are expressed in g kg−1-body-weight.