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Mycotoxin List

ID Name Formula Molecular weight Smiles
2741 Ergotocine

C19H23N3O2

325.40 g/mol

CC(CO)NC(=O)C1CN(C2CC3=CNC4=CC=CC(=C34)C2=C1)C

2742 Ergotoxine

C28H33N5O5

519.60 g/mol

CC(C)C1(C(=O)N2CC(=O)N3CCCC3C2(O1)O)NC(=O)C4CN(C5CC6=CNC7=CC=CC(=C67)C5=C4)C

2743 Isofumigaclavine A

C18H22N2O2

298.40 g/mol

CC1CN(C2CC3=CNC4=CC=CC(=C34)C2C1OC(=O)C)C

2744 Isofumigaclavine B

C16H20N2O

256.34 g/mol

CC1CN(C2CC3=CNC4=CC=CC(=C34)C2C1O)C

2745 Isolysergol

C16H18N2O

254.33 g/mol

CN1CC(C=C2C1CC3=CNC4=CC=CC2=C34)CO

2746 Isosetoclavine

C16H18N2O

254.33 g/mol

CC1(CN(C2CC3=CNC4=CC=CC(=C34)C2=C1)C)O

2747 alpha-Ergocryptinine

C32H41N5O5

575.70 g/mol

CC(C)CC1C(=O)N2CCCC2C3(N1C(=O)C(O3)(C(C)C)NC(=O)C4CN(C5CC6=CNC7=CC=CC(=C67)C5=C4)C)O

2748 Beta-Ergocryptinine

C32H41N5O5

575.70 g/mol

CCC(C)C1C(=O)N2CCCC2C3(N1C(=O)C(O3)(C(C)C)NC(=O)C4CN(C5CC6=CNC7=CC=CC(=C67)C5=C4)C)O

2749 Phthioic acid

C26H52O2

396.70 g/mol

CCCCC(C)CCCCCC(C)CCCCCCCCCC(C)CC(=O)O

2750 Beta-Ergoptine

C31H39N5O5

561.70 g/mol

CCC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC(C)C)NC(=O)C4CN(C5CC6=CNC7=CC=CC(=C67)C5=C4)C