AC1O5AHR structure

AC1O5AHR

(Z)-7-[(1R,2R,3R,5S)-2-[[(2S)-3-(3,4-dimethylphenoxy)-2-hydroxypropanoyl]amino]-3,5-dihydroxycyclopentyl]hept-5-enoic acid

Also Known As: 7-(N-(2S-Hydroxy-2-(3,4-dimethylphenyloxy)ethylcarbonyl)-2-amino-3,5-dihydroxycylopentyl)-5-heptenoic acid|5-Heptenoic acid, 7-(2-((3-(3,4-dimethylphenoxy)-2-hydroxy-1-oxopropyl)amino)-3,5-dihydroxycyclopentyl)-, (1R-(1alpha(Z),2beta(S*),3alpha,5alpha))-|(Z)-7-[(1R,2R,3R,5S)-2-[[(2S)-3-(3,4-dimethylphenoxy)-2-hydroxypropanoyl]amino]-3,5-dihydroxycyclopentyl]hept-5-enoic acid

CAS: 64768-61-2
Molecular Formula C23H33NO7
Molecular Weight 435.2257 g/mol
LogP 1.47084
Topological Polar Surface Area 136.32 Ų
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 6
Rotatable Bonds 11
Exact Mass 435.2257
Monoisotopic Mass 435.2257
Heavy Atoms 31
Complexity 779.18854

Chemical Identifiers

CAS Number 64768-61-2
SMILES CC1=C(C=C(C=C1)OC[C@@H](C(=O)N[C@H]2[C@@H](C[C@@H]([C@@H]2C/C=C\CCCC(=O)O)O)O)O)C

Product Overview

AC1O5AHR (CAS 64768-61-2), with molecular formula C23H33NO7 and molecular weight 435.2257 g/mol. IUPAC: (Z)-7-[(1R,2R,3R,5S)-2-[[(2S)-3-(3,4-dimethylphenoxy)-2-hydroxypropanoyl]amino]-3,5-dihydroxycyclopentyl]hept-5-enoic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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