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tetracosanoyl-cholesterol

PropertiesImage
MNX_IDMNXM45925 Image of MNXM45925
referenceslm:000500301
formulaC51H92O2
global charge0
mol weight737.295
InChIKeyAMUHTLRUMQYZJF-LTRCVRFVSA-N
InChIInChI=1S/C51H92O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-31-49(52)53-44-36-38-50(5)43(40-44)32-33-45-47-35-34-46(42(4)30-28-29-41(2)3)51(47,6)39-37-48(45)50/h32,41-42,44-48H,7-31,33-40H2,1-6H3/t42-,44+,45+,46-,47+,48+,50+,51-/m1/s1
SMILESCCCCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2(C)C(=CC[C@H]3[C@@H]4CC[C@H]([C@H](C)CCCC(C)C)[C@@]4(C)CC[C@@H]32)C1
MNX internals
InChI (mnx)InChI=1/C51H92O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-31-49(52)53-44-36-38-50(5)43(40-44)32-33-45-47-35-34-46(42(4)30-28-29-41(2)3)51(47,6)39-37-48(45)50/h32,41-42,44-48H,7-31,33-40H2,1-6H3/t42-,44+,45+,46-,47+,48+,50+,51-/m1/s1 Image of MNXM45925
SMILES (mnx)[CH3:1][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:31][C:49](=[O:52])[O:53][C@H:44]1[CH2:36][CH2:38][C@@:50]2([CH3:5])[C:43](=[CH:32][CH2:33][C@H:45]3[C@@H:47]4[CH2:35][CH2:34][C@H:46]([C@H:42]([CH3:4])[CH2:30][CH2:28][CH2:29][CH:41]([CH3:2])[CH3:3])[C@@:51]4([CH3:6])[CH2:39][CH2:37][C@@H:48]32)[CH2:40]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

SLM:000500301
slm:000500301
AMUHTLRUMQYZJF-LTRCVRFVSA-N 		tetracosanoyl-cholesterol
CE(24:0)
Cholesteryl ester (24:0)
Cholesteryl tetracosanoate
hmdb:HMDB0010376
AMUHTLRUMQYZJF-HVZUPDIGSA-N 		CE(24:0)
(2R,5S,15R)-2,15-Dimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-7-en-5-yl tetracosanoic acid
(2R,5S,15R)-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-7-en-5-yl tetracosanoate
1-lignoceroyl-cholesterol
1-tetracosanoyl-cholesterol
24:0 cholesterol ester
CE(24:0/0:0)
Cholesterol Ester(24:0)
Cholesterol Ester(24:0/0:0)
cholesterol 1-lignoceroate
cholesterol 1-lignoceroic acid
cholesterol 1-tetracosanoate
cholesterol 1-tetracosanoic acid
cholesteryl 1-lignoceroate
cholesteryl 1-lignoceroic acid
cholesteryl 1-tetracosanoate
cholesteryl 1-tetracosanoic acid

CHEBI:88740
chebi:88740
AMUHTLRUMQYZJF-HVZUPDIGSA-N 		CE(24:0)
(2R,5S,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 tetracosanoate
1-Lignoceroyl-cholesterol
24:0 Cholesterol ester
CE(24:0/0:0)
Cholesterol 1-lignoceroate
Cholesterol 1-lignoceroic acid
Cholesterol 1-tetracosanoate
Cholesterol 1-tetracosanoic acid
Cholesterol Ester(24:0)
Cholesterol Ester(24:0/0:0)
Cholesteryl 1-lignoceroate
Cholesteryl 1-lignoceroic acid
Cholesteryl 1-tetracosanoate
Cholesteryl 1-tetracosanoic acid

hmdb:HMDB10376 		secondary/obsolete/fantasy identifier