Xanthoepocin

Formula: C30H22O14
Molecular weight: 606.50
Smiles: CC1=CC2=CC3=C(C(C4(C(C3=O)(O4)OC)C56C(C7=C(C=C8C=C(OC(=O)C8=C7O)C)C(=O)C5(O6)OC)O)O)C(=C2C(=O)O1)O

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Xanthoepocin

Names

Structural Information

Physico-chemical Properties

ADME

Toxicity

Medical Chemistry

Fungi

Mycotoxin name: Xanthoepocin
First synonym: Xanthoepocin
Synonyms: Xanthoepocin,Xanthoepocin_130120,BS-1362,(dihydroxy-methoxy-methyl-dioxo-[?]yl)-dihydroxy-methoxy-methyl-[?]dione

Smiles: CC1=CC2=CC3=C(C(C4(C(C3=O)(O4)OC)C56C(C7=C(C=C8C=C(OC(=O)C8=C7O)C)C(=O)C5(O6)OC)O)O)C(=C2C(=O)O1)O
Isomeric smiles: CC1=CC2=CC3=C(C(C4(C(C3=O)(O4)OC)C56C(C7=C(C=C8C=C(OC(=O)C8=C7O)C)C(=O)C5(O6)OC)O)O)C(=C2C(=O)O1)O
Inchi: InChI=1S/C30H22O14/c1-9-5-11-7-13-17(19(31)15(11)25(37)41-9)23(35)27(29(39-3,43-27)21(13)33)28-24(36)18-14(22(34)30(28,40-4)44-28)8-12-6-10(2)42-26(38)16(12)20(18)32/h5-8,23-24,31-32,35-36H,1-4H3
Inchikey: KJPAOKCLRDGPMI-UHFFFAOYSA-N

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Endpoint	Tool	Value	Unit	Comments	Reference

Fungi id	Species
924	Penicillium simplicissimum IFO5762