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Chaetochromin a

  • Formula: C30H26O10

  • Molecular weight: 546.50

  • Smiles: CC1C(OC2=C(C1=O)C(=C3C(=C2)C(=C(C=C3O)O)C4=C(C=C(C5=C(C6=C(C=C54)OC(C(C6=O)C)C)O)O)O)O)C

  • Type: Naphtho-γ-pyrone dimer

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Chaetochromin a

Names
Structural Information
Physico-chemical Properties
ADME
Toxicity
Medical Chemistry
Fungi

Names

  • Mycotoxin name: Chaetochromin a

  • First synonym: Chaetochromin a

  • Synonyms: Chaetochromin A,UNII-YME4GS90I1,YME4GS90I1,(2R,3R)-5,6,8-trihydroxy-2,3-dimethyl-9-[(2R,3R)-5,6,8-trihydroxy-2,3-dimethyl-4-oxo-2,3-dihydrobenzo[g]chromen-9-yl]-2,3-dihydrobenzo[g]chromen-4-one,75514-37-3,NCIMech_000037,Bis(naphthodihydropyran-4-one),CHEMBL1099258,SCHEMBL17065496,BDBM50388865,CCG-35423,CCG-36054,NSC 345647,(9,9'-Bi-4H-naphtho(2,3-b)pyran)-4,4'-dione, 2,2',3,3'-tetrahydro-5,5',6,6',8,8'-hexahydroxy-2,2',3,3'-tetramethyl-, stereoisomer

Identifiers / External links

Structure

  • Smiles: CC1C(OC2=C(C1=O)C(=C3C(=C2)C(=C(C=C3O)O)C4=C(C=C(C5=C(C6=C(C=C54)OC(C(C6=O)C)C)O)O)O)O)C

  • Isomeric smiles: CC1C(OC2=C(C1=O)C(=C3C(=C2)C(=C(C=C3O)O)C4=C(C=C(C5=C(C6=C(C=C54)OC(C(C6=O)C)C)O)O)O)O)C

  • Inchi: InChI=1S/C30H26O10/c1-9-11(3)39-19-5-13-21(15(31)7-17(33)23(13)29(37)25(19)27(9)35)22-14-6-20-26(28(36)10(2)12(4)40-20)30(38)24(14)18(34)8-16(22)32/h5-12,31-34,37-38H,1-4H3

  • Inchikey: RHNVLFNWDGWACV-UHFFFAOYSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C30H26O10

  • Molecular weight: 546.50

  • Monoisotopic mass: 546.15259702

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