CAS 102191-05-9: (5Z)-7-[(1S,2S,3S,5R)-3-[[(2R)-2-Cyclopentyl-2-hydroxyacetyl]amino]-6,6-dimethylbicyclo[3.1.1]hept-2-yl]-5-heptenoic acid

Description:The chemical substance with the name "(5Z)-7-[(1S,2S,3S,5R)-3-[[(2R)-2-Cyclopentyl-2-hydroxyacetyl]amino]-6,6-dimethylbicyclo[3.1.1]hept-2-yl]-5-heptenoic acid" and CAS number "102191-05-9" is a complex organic compound characterized by its unique bicyclic structure and specific stereochemistry. It features a heptenoic acid moiety, indicating the presence of a double bond within a seven-carbon chain, which contributes to its reactivity and potential biological activity. The compound contains multiple chiral centers, which suggests that it may exhibit stereospecific interactions in biological systems, potentially influencing its pharmacological properties. The presence of a cyclopentyl group and a hydroxyacetyl amino group further enhances its structural complexity and may play a role in its solubility and binding affinity to biological targets. Overall, this compound is of interest in medicinal chemistry, particularly in the development of therapeutics, due to its intricate structure and potential bioactivity.

Formula:C₂₃H₃₇NO₄

InChI:InChI=1S/C23H37NO4/c1-23(2)16-13-18(23)17(11-5-3-4-6-12-20(25)26)19(14-16)24-22(28)21(27)15-9-7-8-10-15/h3,5,15-19,21,27H,4,6-14H2,1-2H3,(H,24,28)(H,25,26)/b5-3-/t16-,17+,18+,19+,21-/m1/s1

InChI key:InChIKey=SXHUZJPIRVLMHY-AZPSIHDESA-N

SMILES:O=C(O)CCCC=CCC1C(NC(=O)C(O)C2CCCC2)CC3CC1C3(C)C

Synonyms:
5-Heptenoic acid, 7-[3-[(cyclopentylhydroxyacetyl)amino]-6,6-dimethylbicyclo[3.1.1]hept-2-yl]-, [1S-[1α,2β(Z),3α(S*),5α]]-
5-Heptenoic acid, 7-[(1S,2S,3S,5R)-3-[[(2R)-cyclopentylhydroxyacetyl]amino]-6,6-dimethylbicyclo[3.1.1]hept-2-yl]-, (5Z)-
5-Heptenoic acid, 7-[(1S,2S,3S,5R)-3-[[(2R)-2-cyclopentyl-2-hydroxyacetyl]amino]-6,6-dimethylbicyclo[3.1.1]hept-2-yl]-, (5Z)-
ONO 3708
(5Z)-7-[(1S,2S,3S,5R)-3-[[(2R)-2-Cyclopentyl-2-hydroxyacetyl]amino]-6,6-dimethylbicyclo[3.1.1]hept-2-yl]-5-heptenoic acid