Cholesteryl Octanoate-[13C]

Datasheet MSDS
Catalog Number
ALP2603
Product Name
Cholesteryl Octanoate-[13C]
Structure
Cholesteryl Octanoate-[13C]
CAS Number
110888-06-7
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] (113C)octanoate
Synonyms
Cholesterol3-octanoate-13C; Cholesteryloctanoate-13C; Cholesterol-3-octanoate-1-13C; Cholesteryloctanoate-1-13C; Cholesterylcaprylate-1-13C; CholesterolN-Octanoate-1-13C; n-OctanoicAcidCholesterolEster-1-13C; Cholest-5-ene-3-beta-yloctanoate-1-13C
Molecular Formula
C34[13C]H60O2
Molecular Weight
513.84
Appearance
Solid
Purity
≥98%;99% atom 13C
SMILES
CCCCCCC[13C](=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/C35H60O2/c1-7-8-9-10-11-15-33(36)37-28-20-22-34(5)27(24-28)16-17-29-31-19-18-30(26(4)14-12-13-25(2)3)35(31,6)23-21-32(29)34/h16,25-26,28-32H,7-15,17-24H2,1-6H3/t26-,28+,29+,30-,31+,32+,34+,35-/m1/s1/i33+1
InChI Key
SKLBBRQPVZDTNM-SPKDLXGUSA-N
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