Cholesteryl hexanoate

Catalog Number	ACM1062960-1
CAS Number	1062-96-0
Synonyms	Cholest-5-en-3beta-yl hexanoate
IUPAC Name	[(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] hexanoate
Molecular Weight	484.8
Molecular Formula	C33H56O2
Canonical SMILES	CCCCCC(=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
InChI	InChI=1S/C33H56O2/c1-7-8-9-13-31(34)35-26-18-20-32(5)25(22-26)14-15-27-29-17-16-28(24(4)12-10-11-23(2)3)33(29,6)21-19-30(27)32/h14,23-24,26-30H,7-13,15-22H2,1-6H3/t24-,26+,27+,28-,29+,30+,32+,33-/m1/s1
InChI Key	FPBODWXATDKICU-FLFWOSPYSA-N
Boiling Point	541.8±29.0 ºC
Melting Point	96 ºC
Purity	98%+
Density	0.98±0.1 g/ml