CAS 29611-03-8

(1S,6aR,9aS)-2,3,6a,9a-Tetrahydro-1-hydroxy-4-methoxycyclopenta[c]furo[3′,2′:4,5]furo[2,3-h][1]benzopyran-11(1H)-one

Description:

The chemical substance known as (1S,6aR,9aS)-2,3,6a,9a-Tetrahydro-1-hydroxy-4-methoxycyclopenta[c]furo[3′,2′:4,5]furo[2,3-h][1]benzopyran-11(1H)-one, with the CAS number 29611-03-8, is a complex organic compound characterized by its unique bicyclic structure that incorporates both furan and benzopyran moieties. This compound features multiple stereocenters, which contribute to its specific three-dimensional arrangement and potentially influence its biological activity. The presence of a methoxy group and a hydroxy group suggests that it may exhibit various chemical reactivities, including hydrogen bonding and potential interactions with biological targets. Its structural complexity indicates that it may possess interesting pharmacological properties, making it a candidate for further research in medicinal chemistry. Additionally, the compound's solubility, stability, and reactivity can be influenced by its functional groups and stereochemistry, which are critical for understanding its behavior in different environments and applications.

Formula: C₁₇H₁₄O₆

InChI: InChI=1S/C17H14O6/c1-20-10-6-11-14(8-4-5-21-17(8)22-11)15-13(10)7-2-3-9(18)12(7)16(19)23-15/h4-6,8-9,17-18H,2-3H2,1H3/t8-,9-,17+/m0/s1

InChI key: InChIKey=WYIWLDSPNDMZIT-IRWWLHRVSA-N

SMILES: O(C)C=1C2=C(C=3[C@]4([C@@](OC3C1)(OC=C4)[H])[H])OC(=O)C5=C2CC[C@@H]5O

Synonyms:

• (1R,6aS,9aS)-1-hydroxy-4-methoxy-2,3,6a,9a-tetrahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromen-11(1H)-one
• (1S,6aR,9aS)-1-hydroxy-4-methoxy-2,3,6a,9a-tetrahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromen-11(1H)-one
• (1S,6aR,9aS)-2,3,6a,9a-Tetrahydro-1-hydroxy-4-methoxycyclopenta[c]furo[3′,2′:4,5]furo[2,3-h][1]benzopyran-11(1H)-one
• (1S-(1alpha,6abeta,9abeta))-2,3,6a,9a-Tetrahydro-1-hydroxy-4-methoxycyclopenta(c)furo(3',2':4,5)furo(2,3-h)(1)benzopyran-11(1H)-one
• AFL
• Aflatoxicol
• Aflatoxicol natural epimer
• Aflatoxin R₀
• Aflatoxin Ro
• Ccris 11
• Cyclopenta(c)furo(3',2':4,5)furo(2,3-h)(1)benzopyran-11(1H)-one, 2,3,6a,9a-tetrahydro-1-hydroxy-4-methoxy-, (1S,6aR,9aS)-
• Cyclopenta[c]furo[3′,2′:4,5]furo[2,3-h][1]benzopyran-11(1H)-one, 2,3,6a,9a-tetrahydro-1-hydroxy-4-methoxy-
• Cyclopenta[c]furo[3′,2′:4,5]furo[2,3-h][1]benzopyran-11(1H)-one, 2,3,6a,9a-tetrahydro-1-hydroxy-4-methoxy-, (1S,6aR,9aS)-

Aflatoxicol

CAS: 29611-03-8

Aflatoxicol

Formula: C₁₇H₁₄O₆

Purity: By hplc: 99.6% (Typical Value in Batch COA)

Color and Shape: White Solid-Powder

Molecular weight: 314.28946

Ref: 54-BIA4321

Aflatoxicol

Controlled Product

CAS: 29611-03-8

Stability Hygroscopic
Applications Aflatoxicol is a reduction metabolite of Aflatoxin B1 (A357460), which is a potent environmental mutagen and carcinogen.
Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package
References Cifford, R., et al.: Nature, 209, 312 (1966); Wogan, et al.: Food Cosmet. Toxicol., 12, 681 (1974); Sinz, M.W., et al.: J. Toxicol. Toxin Rev., 10, 87 (1991); Breinholt, V., et al.: Chem. Res. Toxicol., 8, 506 (1995); Lee, S., et al.: J. Agric. Food Chem., 49, 5171 (2001);

Formula: C₁₇H₁₄O₆

Color and Shape: Neat

Molecular weight: 314.29

Ref: TR-A357543

Aflatoxicol

CAS: 29611-03-8

Aflatoxicol is a derivative of aflatoxin, which is a type of mycotoxin. It is derived from the biochemical transformation of aflatoxins, predominantly by metabolic reduction, often sourced from specific fungi such as *Aspergillus flavus* and *Aspergillus parasiticus*. The mode of action of aflatoxicol involves its interaction with cellular macromolecules, causing disruption and potentially leading to toxic effects, similar to its parent compound. It is known to cause DNA adduct formation, ultimately interfering with genetic integrity.

Purity: Min. 95%

Ref: 3D-BA162706