CAS 100196-22-3

Crinan-1,3-diol, 7-methoxy-, 3-acetate, (1α,3α)-

Description:

Crinan-1,3-diol, 7-methoxy-, 3-acetate, (1α,3α)-, with the CAS number 100196-22-3, is a chemical compound that belongs to the class of organic compounds known as diols and their derivatives. This substance features a diol functional group, which indicates the presence of two hydroxyl (-OH) groups, contributing to its reactivity and solubility in polar solvents. The methoxy group (-OCH3) at the 7-position enhances its lipophilicity, potentially influencing its biological activity and interaction with cellular membranes. The acetate group at the 3-position suggests that the compound may undergo hydrolysis to release acetic acid, which can affect its stability and reactivity. This compound may exhibit various pharmacological properties, making it of interest in medicinal chemistry. Its stereochemistry, indicated by the (1α,3α) designation, suggests specific spatial arrangements of its atoms, which can significantly influence its biological activity and interactions with other molecules. Overall, Crinan-1,3-diol, 7-methoxy-, 3-acetate is a structurally complex compound with potential applications in various fields, including pharmaceuticals and biochemistry.

Formula: C₁₉H₂₃NO₆

InChI: InChI=1/C19H23NO6/c1-10(21)26-11-5-15-19(16(22)6-11)3-4-20(15)8-12-13(19)7-14-18(17(12)23-2)25-9-24-14/h7,11,15-16,22H,3-6,8-9H2,1-2H3/t11-,15-,16-,19+/m1/s1

InChI key: InChIKey=BSVABPABKQCTBP-GZJVQYRHSA-N

SMILES: O[C@H]1[C@@]23C=4C(=C(OC)C5=C(C4)OCO5)C[N@@]([C@@]2(C[C@@H](OC(C)=O)C1)[H])CC3

Synonyms:

• Crinan-1,3-diol, 7-methoxy-, 3-acetate, (1α,3α)-
• 1H,6H-5,11b-Ethano[1,3]dioxolo[4,5-j]phenanthridine-1,3-diol, 2,3,4,4a-tetrahydro-7-methoxy-, 3-acetate
• Buphanitine 3-acetate
• Hemanthine, monoacetyl-
• 1H,6H-5,11b-Ethano[1,3]dioxolo[4,5-j]phenanthridine, crinan-1,3-diol deriv.
• 3-Acetylnerbowdine

3-Acetylnerbowdine

CAS: 100196-22-3

3-Acetylnerbowdine is an alkaloid that can be extracted from N. bowdenii bulbs. It is utilized in the study of acetylcholinesterase activity.

Formula: C₁₉H₂₃NO₆

Color and Shape: Solid

Molecular weight: 361.389

Ref: TM-TN9109