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Mycotoxin List

ID Name Formula Molecular weight Smiles
2761 Fumonisin C4

C33H57NO13

675.80 g/mol

CCCCC(C)C(C(CC(C)CCCCCCCCC(CN)O)OC(=O)CC(CC(=O)O)C(=O)O)OC(=O)CC(CC(=O)O)C(=O)O

2762 Fumonisin P1

C39H62NO16+

800.90 g/mol

CCCCC(C)C(C(CC(C)CC(CCCCC(CC(C(C)[N+]1=CC=CC(=C1)O)O)O)O)OC(=O)CC(CC(=O)O)C(=O)O)OC(=O)CC(CC(=O)O)C(=O)O

2763 Fumonisin P2

C39H62NO15+

784.90 g/mol

CCCCC(C)C(C(CC(C)CCCCCCC(CC(C(C)[N+]1=CC=CC(=C1)O)O)O)OC(=O)CC(CC(=O)O)C(=O)O)OC(=O)CC(CC(=O)O)C(=O)O

2764 5-Hydroxymethylfurfural

C6H6O3

126.11 g/mol

C1=C(OC(=C1)C=O)CO

2765 Bergapten

C12H8O4

216.19 g/mol

COC1=C2C=CC(=O)OC2=CC3=C1C=CO3

2766 Bergaptol

C11H6O4

202.16 g/mol

C1=CC(=O)OC2=CC3=C(C=CO3)C(=C21)O

2767 Psoralen

C11H6O3

186.16 g/mol

C1=CC(=O)OC2=CC3=C(C=CO3)C=C21

2768 Xanthotoxin

C12H8O4

216.19 g/mol

COC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2

2769 Xyloketal A

C27H36O6

456.60 g/mol

CC1COC2(C1CC3=C4C(=C5C(=C3O2)CC6C(COC6(O5)C)C)CC7C(COC7(O4)C)C)C

2770 Xyloketal B

C20H26O5

346.40 g/mol

CC1COC2(C1CC3=C(O2)C=C(C4=C3OC5(C(C4)C(CO5)C)C)O)C