40785-64-6 Usage
Description
[3S,5R,11E,(-)]-3,4,5,6,9,10-Hexahydro-5,14,16-trihydroxy-3-methyl-1H-2-benzoxacyclotetradecin-1,7(8H)-dione is a complex organic compound characterized by a cyclo-tetradecene ring structure. It features multiple hydroxyl groups, a methyl group, and a lactone functional group. [3S,5R,11E,(-)]-3,4,5,6,9,10-Hexahydro-5,14,16-trihydroxy-3-methyl-1H-2-benzoxacyclotetradecin-1,7(8H)-dione's stereochemistry includes a 3S, 5R configuration and an 11E double bond configuration. The intricate arrangement of these functional groups suggests potential biological activity and pharmacological properties, although further research is necessary to explore and confirm its applications.
Uses
Used in Pharmaceutical Industry:
[3S,5R,11E,(-)]-3,4,5,6,9,10-Hexahydro-5,14,16-trihydroxy-3-methyl-1H-2-benzoxacyclotetradecin-1,7(8H)-dione is used as a potential pharmaceutical agent for [application reason] due to its complex structure and multiple functional groups, which may exhibit specific biological activities.
Used in Chemical Research:
In the field of chemical research, [3S,5R,11E,(-)]-3,4,5,6,9,10-Hexahydro-5,14,16-trihydroxy-3-methyl-1H-2-benzoxacyclotetradecin-1,7(8H)-dione serves as a subject for studying the effects of stereochemistry and functional group arrangement on compound properties and reactivity.
Used in Drug Development:
[3S,5R,11E,(-)]-3,4,5,6,9,10-Hexahydro-5,14,16-trihydroxy-3-methyl-1H-2-benzoxacyclotetradecin-1,7(8H)-dione is used as a lead molecule in drug development for [specific therapeutic area] because of its unique structural features that may provide advantages in targeting certain biological pathways or receptors.
Check Digit Verification of cas no
The CAS Registry Mumber 40785-64-6 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 4,0,7,8 and 5 respectively; the second part has 2 digits, 6 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 40785-64:
(7*4)+(6*0)+(5*7)+(4*8)+(3*5)+(2*6)+(1*4)=126
126 % 10 = 6
So 40785-64-6 is a valid CAS Registry Number.
InChI:InChI=1/C18H22O6/c1-11-7-14(20)9-13(19)6-4-2-3-5-12-8-15(21)10-16(22)17(12)18(23)24-11/h3,5,8,10-11,14,20-22H,2,4,6-7,9H2,1H3/b5-3-/t11-,14+/m0/s1
40785-64-6Relevant articles and documents
Microbial Transformation of Zearalenone. 2. Reduction, Hydroxylation, and Methylation Products
El-Sharkawy, Saleh H.,Abul-Hajj, Yusuf J.
, p. 515 - 519 (2007/10/02)
Microbial transformations have been employed as a means of preparing analogues of the resorcylic acid lactone zearalenone.Microbial transformation products were initially identified by thin-layer chromatography of fermentation extracts and then prepared by large-scale incubations.Each metabolite was subjected to structural elucidation employing carbon-13 and proton NMR, mass spectrometry, and infrared analysis.Metabolites were identified as α- and β-zearalenol, α- and β-zearalanol, zearalanone, 8'(S)-hydroxyzearalenone, 2,4-dimethoxyzearalenone, and 2-methoxyzearalenone.Binding affinities to rat uterine estrogen receptors were carried out.Only those metabolites having a free 4-phenolic group were capable of binding to the estrogen receptor.However, 8'-hydroxyzearalenone, even with a 4-phenolic hydroxyl, did not bind to the receptor.It is possible that hydrogen bonding of the aliphatic hydroxyl groups to the C-6' carbonyl of zearalenone or equilibrium between the hydroxy ketone and its tautomeric hemiketal may lead to distortion of the conformation of the molecule resulting in loss of binding to the receptor.
