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Chemical structure of Cholesteryl Arachidate

GC43254

Cholesteryl Arachidate

Also known as [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] icosanoate

Cholesteryl arachidate is a cholesterol ester that has been found in human meibum

ChemicalCAS2573-03-7MW681.2FormulaC47H84O2
CAS number
2573-03-7
Molecular weight
681.2
Formula
C47H84O2
Solubility
10mg/mL in Chloroform
InChIKey
SUOVMGLZSOAHJY-JREUTYQLSA-N
Catalogue number
GC43254
Brand
GLPBIO
Computed properties PubChem CID 16061336 · XLogP 18.6 · TPSA 26.3 Ų · H-bond donors 0
XLogP
18.6
TPSA
26.3 Ų
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
25
Heavy atoms
49

SMILES CCCCCCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C

Computed descriptors from PubChem (CID 16061336), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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