Rubrosulphin

Formula: C29H20O10
Molecular weight: 528.50
Smiles: CC1CC2=CC3=C(C(=C2C(=O)O1)O)C(=O)C4=C(C3=O)OC5=C4C(=CC6=CC7=C(C(=C65)O)C(=O)OC(C7)C)OC
Type: Isocoumarin-dibenzopyran R

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Rubrosulphin

Names

Structural Information

Physico-chemical Properties

ADME

Toxicity

Medical Chemistry

Fungi

Mycotoxin name: Rubrosulphin
First synonym: Rubrosulphin
Synonyms: Rubrosulphin,55713-15-0,1H,8H-Furo(2'',3'':6,7:4'',5'':7',8')dinaphtho(2,3-c:2',3'-c')dipyran-1,8,10,15-tetrone, 3,4,12,13-tetrahydro-9,17-dihydroxy-7-methoxy-3,12-dimethyl-, (3R-cis)-

Smiles: CC1CC2=CC3=C(C(=C2C(=O)O1)O)C(=O)C4=C(C3=O)OC5=C4C(=CC6=CC7=C(C(=C65)O)C(=O)OC(C7)C)OC
Isomeric smiles: C[C@@H]1CC2=CC3=C(C(=C2C(=O)O1)O)C(=O)C4=C(C3=O)OC5=C4C(=CC6=CC7=C(C(=C65)O)C(=O)O[C@@H](C7)C)OC
Inchi: InChI=1S/C29H20O10/c1-9-4-11-6-13-8-15(36-3)20-21-25(33)19-14(7-12-5-10(2)38-29(35)18(12)24(19)32)22(30)27(21)39-26(20)16(13)23(31)17(11)28(34)37-9/h6-10,31-32H,4-5H2,1-3H3/t9-,10-/m1/s1
Inchikey: XRRCXEFWLWRGLZ-NXEZZACHSA-N

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Fungi id	Species
170	Aspergillus melleus
257	Aspergillus sulphureus