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cholesteryl hexadecanoate

Properties

Image

Occurences in reactions

MNX_ID

MNXM730833

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	11

formula

C₄₃H₇₆O₂

charge

mass

624.58453

reference

chebi:3663

InChIKey

BBJQPKLGPMQWBU-JADYGXMDSA-N

InChI

InChI=1S/C43H76O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-23-41(44)45-36-28-30-42(5)35(32-36)24-25-37-39-27-26-38(34(4)22-20-21-33(2)3)43(39,6)31-29-40(37)42/h24,33-34,36-40H,7-23,25-32H2,1-6H3/t34-,36+,37+,38-,39+,40+,42+,43-/m1/s1

SMILES

CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2(C)C(=CC[C@@H]3[C@@H]2CC[C@@]2(C)[C@H]3CC[C@@H]2[C@H](C)CCCC(C)C)C1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:3663 chebi:3663	cholesteryl hexadecanoate (3beta)-cholest-5-en-3-ol hexadecanoate (3beta)-cholest-5-en-3-yl hexadecanoate 16:0 Cholesterol ester CE CE(16:0) Cholesteryl palmitate Palmitic acid cholesteryl ester cholesterol palmitate cholesteryl palmitate hexadecanoic acid, cholesteryl ester
lipidmaps:LMST01020005 lipidmapsM:LMST01020005	16:0 Cholesterol ester CE 16:0 CE(16:0) cholest-5-en-3beta-yl hexadecanoate
hmdb:HMDB0000885	CE(16:0) (1S,2R,5S,10S,11S,14R,15R)-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-7-en-5-yl hexadecanoate (3b)-Cholest-5-en-3-ol hexadecanoate (3b)-Cholest-5-en-3-ol hexadecanoic acid (3beta)-Cholest-5-en-3-ol hexadecanoate (3beta)-Cholest-5-en-3-ol hexadecanoic acid (3beta)-cholest-5-en-3-ol hexadecanoate (3beta)-cholest-5-en-3-ol hexadecanoic acid 1-Hexadecanoyl-cholesterol 1-Palmitoyl-cholesterol 16:0 Cholesterol ester 5-Cholesten-3beta-ol stearate CE CE(16:0/0:0) Cholest-5-en-3-yl palmitate Cholest-5-en-3beta-ol stearate Cholest-5-ene-3-beta-yl palmitate Cholesterol 1-hexadecanoate Cholesterol 1-hexadecanoic acid Cholesterol 1-palmitoate Cholesterol 1-palmitoic acid Cholesterol Ester(16:0) Cholesterol Ester(16:0/0:0) Cholesterol hexadecanoate Cholesterol palmitate Cholesterol palmitic acid Cholesteryl 1-hexadecanoate Cholesteryl 1-hexadecanoic acid Cholesteryl 1-palmitoate Cholesteryl 1-palmitoic acid Cholesteryl hexadecanoate Cholesteryl hexadecanoic acid Cholesteryl palmitate Cholesteryl palmitic acid Hexadecanoate Hexadecanoate, cholesteryl ester Hexadecanoic acid Hexadecanoic acid cholesteryl ester Hexadecanoic acid, cholesteryl ester Palmitate cholesteryl ester Palmitic acid cholesteryl ester
bigg.metabolite:HC02020 biggM:HC02020	Cholesterol-ester-palm
sabiork.compound:13323 sabiorkM:13323 seed.compound:cpd08114 seedM:cpd08114 kegg.compound:C11251 keggC:C11251	Cholesteryl palmitate
metacyc.compound:CPD-21814 metacycM:CPD-21814	cholesteryl palmitate (3beta)-cholest-5-en-3-yl hexadecanoate cholesterol palmitate cholesteryl hexadecanoate
SLM:000389778 slm:000389778	hexadecanoyl-cholesterol CE(16:0) Cholesteryl ester (16:0) Cholesteryl hexadecanoate
hmdb:HMDB0005188 hmdb:HMDB00885 hmdb:HMDB05188 chebi:84319 biggM:M_HC02020 keggC:M_C11251 seedM:M_cpd08114	secondary/obsolete/fantasy identifier