AC1O5HSQ structure

AC1O5HSQ

(Z)-7-[(2R)-2-[(E,3R)-4-hexoxy-3-hydroxybut-1-enyl]-3,5-dihydroxycyclopentyl]hept-5-enoic acid

Also Known As: 5-Heptenoic acid, 7-(3,5-dihydroxy-2-(4-(hexyloxy)-3-hydroxy-1-butenyl)cyclopentyl)-, (1R-(1-alpha(Z),2-beta(1E,3S*),3-alpha,5-alpha))-|5-Heptenoic acid, 7-(2-(4-(hexyloxy)-3-hydroxy-1-butenyl)-3,5-dihydroxycyclopentyl)-, (1R-(1alpha(Z),2beta(1E,3S*),3alpha,5alpha))-|5-HEPTENOIC ACID, 7-(3,5-DIHYDROXY-2-(4-(HEXYLOXY)-3-HYDROXY-1-BUTENYL)CYCLOPENT|(Z)-7-[(2R)-2-[(E,3R)-4-hexoxy-3-hydroxybut-1-enyl]-3,5-dihydroxycyclopentyl]hept-5-enoic acid

CAS: 41641-80-9
Molecular Formula C22H38O6
Molecular Weight 398.26685 g/mol
LogP 3.0595
Topological Polar Surface Area 107.22 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 5
Rotatable Bonds 15
Exact Mass 398.26685
Monoisotopic Mass 398.26685
Heavy Atoms 28
Complexity 475.64743

Chemical Identifiers

CAS Number 41641-80-9
SMILES CCCCCCOC[C@@H](/C=C/[C@H]1C(CC(C1C/C=C\CCCC(=O)O)O)O)O

Product Overview

AC1O5HSQ (CAS 41641-80-9), with molecular formula C22H38O6 and molecular weight 398.26685 g/mol. IUPAC: (Z)-7-[(2R)-2-[(E,3R)-4-hexoxy-3-hydroxybut-1-enyl]-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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