MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

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cholesterol

	Properties	Image
MNX_ID	MNXM1584764
reference	chebi:16113
formula	C₂₇H₄₆O
global charge	0
mol weight	386.664
InChIKey	HVYWMOMLDIMFJA-DPAQBDIFSA-N
InChI	InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1
SMILES	CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C

MNX internals

InChI (mnx)	InChI=1/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1
SMILES (mnx)	[CH3:1][CH:18]([CH3:2])[CH2:7][CH2:6][CH2:8][C@@H:19]([CH3:3])[C@H:23]1[CH2:11][CH2:12][C@H:24]2[C@@H:22]3[CH2:10][CH:9]=[C:20]4[CH2:17][C@@H:21]([OH:28])[CH2:13][CH2:15][C@:26]4([CH3:4])[C@H:25]3[CH2:14][CH2:16][C@:27]12[CH3:5]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	322
in models (compartimentalized)	300

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-163586 reactomeM:R-ALL-163586 reactome:R-ALL-171069 reactomeM:R-ALL-171069 reactome:R-ALL-171083 reactomeM:R-ALL-171083 reactome:R-ALL-171095 reactomeM:R-ALL-171095 reactome:R-ALL-171135 reactomeM:R-ALL-171135 reactome:R-ALL-171149 reactomeM:R-ALL-171149 reactome:R-ALL-174672 reactomeM:R-ALL-174672 reactome:R-ALL-176478 reactomeM:R-ALL-176478 reactome:R-ALL-193156 reactomeM:R-ALL-193156 reactome:R-ALL-193384 reactomeM:R-ALL-193384 reactome:R-ALL-193840 reactomeM:R-ALL-193840 reactome:R-ALL-216762 reactomeM:R-ALL-216762 reactome:R-ALL-2239405 reactomeM:R-ALL-2239405 reactome:R-ALL-2429660 reactomeM:R-ALL-2429660 reactome:R-ALL-8847704 reactomeM:R-ALL-8847704 reactome:R-ALL-8848047 reactomeM:R-ALL-8848047 reactome:R-ALL-8866305 reactomeM:R-ALL-8866305 reactome:R-ALL-8876478 reactomeM:R-ALL-8876478 reactome:R-ALL-8951853 reactomeM:R-ALL-8951853 CHEBI:16113 chebi:16113 HVYWMOMLDIMFJA-DPAQBDIFSA-N	cholesterol (3beta,14beta,17alpha)-cholest-5-en-3-ol CHOLESTEROL Cholest-5-en-3beta-ol Cholesterin Cholesterol cholest-5-en-3beta-ol
kegg.drug:D00040 keggD:D00040 HVYWMOMLDIMFJA-DPAQBDIFSA-N	Cholesterol (JP18/NF)
lipidmaps:LMST01010093 lipidmapsM:LMST01010093 HVYWMOMLDIMFJA-DPAQBDIFSA-N	Cholesterol(d7) cholest-5-en-3beta-ol(d7)
CHEBI:172955 chebi:172955 HVYWMOMLDIMFJA-DPAQBDIFSA-N	Cholesterol_d7 (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6,7,7,7-tetradeuterio-6-(trideuteriomethyl)heptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
hmdb:HMDB0000067 HVYWMOMLDIMFJA-DPAQBDIFSA-N	Cholesterol (-)-Cholesterol (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-ol (3b,14b,17a)-Cholest-5-en-3-ol (3beta)-Cholest-5-en-3-ol (3beta)-cholest-5-en-3-ol (3beta,14beta,17alpha)-Cholest-5-en-3-ol (3beta,14beta,17alpha)-cholest-5-en-3-ol 3beta-Hydroxycholest-5-ene 3beta-hydroxycholest-5-ene 5:6-Cholesten-3beta-ol Cholest-5-en-3b-ol Cholest-5-en-3beta-ol Cholesterin Cholesterine Cholesterol base H Cholesteryl alcohol Cholestrin Cholestrol Cordulan Dastar Dusoline Dusoran Dythol Fancol CH Hydrocerin Kathro Lanol Super hartolan Tegolan delta5-Cholesten-3beta-ol
vmhM:xol vmhM:xol vmhmetabolite:xol vmhmetabolite:xol HVYWMOMLDIMFJA-DPAQBDIFSA-N	Cholesterol (-)-Cholesterol (3b,14b,17a)-Cholest-5-en-3-ol (3beta)-Cholest-5-en-3-ol (3beta)-cholest-5-en-3-ol (3beta,14beta,17alpha)-Cholest-5-en-3-ol (3beta,14beta,17alpha)-cholest-5-en-3-ol 3beta-Hydroxycholest-5-ene 3beta-hydroxycholest-5-ene 5:6-Cholesten-3beta-ol Adipose Aml Beautification product Benign nonnephropathic Body fat Cell signaling agent Cellular membrane Cerebrovascular accident Cerebrovascular insult Chaos Cholest-5-en-3b-ol Cholest-5-en-3beta-ol Cholesterin Cholesterine Cholesterol Cholesterol base H Cholesteryl alcohol Cholestrin Cholestrol Coffee Coffee bean Cordulan Csf Ctx Cucurbits Cva Cvi Cystinosis Cystonisis Cytoplasma Dastar Digestion Disseminated sclerosis Dusoline Dusoran Dyslipidemia Dythol Early-onset or infantile nephropathic type Encephalomyelitis disseminata Er Extracellular region Faecal Faeces Fancol CH Fat tissue Fauna Fecal Flora Gall-bladder disease Gallstone disease Gallstones Gastric cancer Golgi apparatus Golgi complex Golgi ribbon Gourds Gramineae Hydrocerin Hyperlipidaemia Hyperlipoproteinemia Inflammation agent Insulin resistance Insulin resistance syndrome Kathro Lanol Late onset type Legume Lipid metabolic process Liver tissue Membrane integrity agent Membrane stability agent Metabolic syndrome x Ms Ocular nonnephropathic Papilionoideae Pcp Personal hygiene Prostate gland Reaven's syndrome Signal transduction Signaling agent Signalling molecule Soy Soya Soya bean Soybean Stool Super hartolan Surface-active agent Syndrome x Tegolan Toiletries Toiletry delta5-Cholesten-3beta-ol
lipidmaps:LMST01010001 lipidmapsM:LMST01010001 HVYWMOMLDIMFJA-DPAQBDIFSA-N	Cholesterol (3beta)-Cholest-5-en-3-ol Cholest-5-en-3-ol Cholesterol Cholesteryl alcohol O ST 27:1 cholest-5-en-3beta-ol
seed.compound:cpd00160 seedM:cpd00160 HVYWMOMLDIMFJA-DPAQBDIFSA-N	Cholesterol 5-cholestene-3beta-ol Cholest-5-en-3beta-ol cholesterol
kegg.compound:C00187 keggC:C00187 HVYWMOMLDIMFJA-DPAQBDIFSA-N	Cholesterol Cholest-5-en-3beta-ol
bigg.metabolite:chsterol biggM:chsterol HVYWMOMLDIMFJA-DPAQBDIFSA-N	Chsterol c
SLM:000000287 slm:000000287 HVYWMOMLDIMFJA-DPAQBDIFSA-N	cholesterol
CHEBI:140435 chebi:140435 HVYWMOMLDIMFJA-DPAQBDIFSA-N	cholesterol-2,2,3,4,4,6-d6 (2,2,3,4,4,6-(2)H6)cholest-5-en-3beta-ol (2,2,3,4,4,6-(2)H6)cholesterol 3beta-hydroxy-5-cholestene-2,2,3,4,4,5-d6 5-cholesten-3beta-ol-2,2,3,4,4,5-d6
metacyc.compound:CHOLESTEROL metacycM:CHOLESTEROL HVYWMOMLDIMFJA-DPAQBDIFSA-N	cholesterol 5-cholestene-3beta-ol
hmdb:HMDB0000507 hmdb:HMDB00067 hmdb:HMDB00507 hmdb:HMDB0062453 hmdb:HMDB62453 chebi:13982 chebi:23204 chebi:3659 chebi:41564 vmhM:chsterol vmhM:chsterol biggM:M_chsterol keggC:M_C00187 keggD:M_D00040 seedM:M_cpd00160 vmhM:M_xol	secondary/obsolete/fantasy identifier