CAS 157659-79-5: (1S,2R,3S)-1-(1,3-Benzodioxol-5-yl)-3-[2-(carboxymethoxy)-4-methoxyphenyl]-2,3-dihydro-5-propoxy-1H-indene-2-carboxylic acid

Description:The chemical substance with the name "(1S,2R,3S)-1-(1,3-Benzodioxol-5-yl)-3-[2-(carboxymethoxy)-4-methoxyphenyl]-2,3-dihydro-5-propoxy-1H-indene-2-carboxylic acid" and CAS number "157659-79-5" is a complex organic compound characterized by its multi-ring structure and various functional groups. It features a benzodioxole moiety, which is known for its potential biological activity, and includes carboxylic acid and methoxy groups that may enhance its solubility and reactivity. The stereochemistry indicated by the (1S,2R,3S) configuration suggests specific spatial arrangements of atoms, which can significantly influence the compound's pharmacological properties. This substance may exhibit properties relevant to medicinal chemistry, particularly in the development of therapeutic agents. Its structural complexity implies potential interactions with biological targets, making it a candidate for further research in drug discovery and development. However, detailed studies would be necessary to elucidate its specific biological activities and mechanisms of action.

Formula:C₂₉H₂₈O₉

InChI:InChI=1S/C29H28O9/c1-3-10-35-18-6-7-19-21(12-18)27(20-8-5-17(34-2)13-23(20)36-14-25(30)31)28(29(32)33)26(19)16-4-9-22-24(11-16)38-15-37-22/h4-9,11-13,26-28H,3,10,14-15H2,1-2H3,(H,30,31)(H,32,33)/t26-,27+,28+/m0/s1

InChI key:InChIKey=UUAVCCWBNUITBB-UPRLRBBYSA-N

SMILES:O=C(O)COC1=CC(OC)=CC=C1C2C3=CC(OCCC)=CC=C3C(C4=CC=C5OCOC5=C4)C2C(=O)O

Synonyms:
SKB 209670
1H-Indene-2-carboxylic acid, 1-(1,3-benzodioxol-5-yl)-3-[2-(carboxymethoxy)-4-methoxyphenyl]-2,3-dihydro-5-propoxy-, [1S-(1α,2β,3α)]-
(1S,2R,3S)-1-(1,3-Benzodioxol-5-yl)-3-[2-(carboxymethoxy)-4-methoxyphenyl]-2,3-dihydro-5-propoxy-1H-indene-2-carboxylic acid
SB 209670
1H-Indene-2-carboxylic acid, 1-(1,3-benzodioxol-5-yl)-3-[2-(carboxymethoxy)-4-methoxyphenyl]-2,3-dihydro-5-propoxy-, (1S,2R,3S)-