This website is for informational and educational purposes only. Please do not self-medicate; contact a medical professional for advice before administration. This website is for informational and educational purposes only. Please do not self-medicate; contact a medical professional for advice before administration.

Cholesterol

PubChem CID: 5997

Connections displayed (default: 10).
Loading graph...

Compound Synonyms cholesterol, 57-88-5, Cholesterin, Cholest-5-en-3beta-ol, Cholesteryl alcohol, Dythol, Cholestrin, Cordulan, Dusoline, Dusoran, Cholesterine, Cholestrol, Hydrocerin, Lidinite, Kathro, Lanol, Super hartolan, Lidinit, Cholesterol base H, Provitamin D, Nimco cholesterol base H, (-)-Cholesterol, Cholesterinum, Tegolan, 5:6-Cholesten-3beta-ol, 3beta-Hydroxycholest-5-ene, Tegolan (VAN), Cholest-5-en-3-beta-ol, 5-Cholesten-3beta-ol, (3beta)-cholest-5-en-3-ol, CCRIS 2834, (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-ol, Cholest-5-en-3-ol (3beta)-, HSDB 7106, Cholest-5-en-3-ol, 3beta-Hydroxy-5-cholestene, NSC 8798, 3-beta-Hydroxycholest-5-ene, 5-Cholesten-3B-ol, Cholest-5-en-3-ol (3.beta.)-, Dastar, CHEBI:16113, Provitamin-d, Cholest-5-en-3-ol, (3beta)-, AI3-03112, delta(sup 5)-Cholesten-3-beta-ol, Fancol CH, NSC-8798, 3h-cholesterol, EINECS 200-353-2, UNII-97C5T2UQ7J, 97C5T2UQ7J, DTXSID3022401, Nimco cholesterol base No. 712, NSC8798, 5-cholestene-3beta-ol, Cholesterol (Excipient), 5:6-Cholesten-3-ol, (3beta,14beta,17alpha)-cholest-5-en-3-ol, MFCD00003646, 5-Cholesten-3.beta.-ol, Cholest-5-en-3.beta.-ol, 5,6-Cholesten-3.beta.-ol, 3.beta.-Hydroxycholest-5-ene, DTXCID402401, EC 200-353-2, 129111-15-5, NCGC00159351-02, CHOLESTEROL (II), CHOLESTEROL [II], CHOLESTEROL (IARC), CHOLESTEROL [IARC], CHOLESTEROL (MART.), CHOLESTEROL [MART.], CHOLESTEROL (USP-RS), CHOLESTEROL [USP-RS], CHOLESTEROL (EP MONOGRAPH), CHOLESTEROL [EP MONOGRAPH], Cholesterol-t, (3S,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol, (3H)-Cholesterol, epicholesterin, Cholesterol [BAN:JAN:NF], Cholesterol?, .DELTA.5-Cholesten-3-.beta.-ol, 80356-14-5, 1zhy, Cholesterol,(S), Cholest-5-en-3-ol, (3.beta.)- #, Cholesterol1551, Cholesterol (TN), 20-epi-cholesterol, 20-iso-cholesterol, Cholesterol, 94%, Liquid crystal CN/9, (+)-ent-Cholesterol, cholest-5-en-3b-ol, 5-Cholesten-3ss--ol, Cholesterol (Standard), Cholesterol (>99%), Cholesterol, 99.0%, CHOLESTEROL [MI], ALF component cholesterol, CHOLESTEROL [JAN], ALFQ component cholesterol, Cholesterol (JP18/NF), CHOLESTEROL [HSDB], Phospholipon & Cholesterol, Delta5-Cholesten-3beta-ol, Epitope ID:150761, CHOLESTEROL [VANDF], 3beta-cholest-5-en-3-ol, 3ss--Hydroxy-5-cholestene, CHOLESTERINUM [HPUS], BIDD:PXR0095, (3b)-cholest-5-en-3-ol, CHOLESTEROL [WHO-DD], 5:6-Cholesten-3.beta.-ol, 20bFH-cholest-5-en-3b-ol, BIDD:ER0548, Cholest-5-en-3-ol (3beta)-, labeled with tritium, CHEMBL112570, Cholest-5-en-3-ol (3beta), GTPL2718, BDBM20192, HY-N0322B, HY-N0322R, (20bFH)-cholest-5-en-3b-ol, CHEBI:140435, (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-((R)-6-methylheptan-2-yl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol, Cholesterol, Sigma Grade, >=99%, HY-N0322, Tox21_111595, CMC_13392, LMST01010001, s4154, AKOS005267135, Cholest-5-en-3-ol, (3-.beta.)-, CS-5106, DB04540, FC28806, GS-6857, CAS-57-88-5, Cholesterol, NIST(R) SRM(R) 911c, SMP1_000069, NCGC00159351-03, 22243-67-0, BP-26125, Cholesterol 10 microg/mL in Acetonitrile, Cholesterol, tested according to Ph.Eur., C3624, Cholesterol, from lanolin, >=95.0% (GC), Cholesterol, from lanolin, >=99.0% (GC), CS-1096707, NS00005787, Army Liposome Formulation component cholesterol, C00187, D00040, EN300-323186, F70214, Q43656, AB00443913_03, Cholesterol, >=95% (GC), powder, Ash, free, Cholesterol, Vetec(TM) reagent grade, >=92.5%, Soya phospholipon & Cholesterol (2:1 molar ratio), 5BBA213B-ECF4-44AF-8AAF-8A0120F2F886, WLN: L E5 B666 LUTJ A1 E1 FY1&3Y1&1 OQ, Z2033589790, Cholesterol, powder, BioReagent, suitable for cell culture, >=99%, Cholesterol, United States Pharmacopeia (USP) Reference Standard, Cholesterol, Pharmaceutical Secondary Standard, Certified Reference Material, (1R,3aS,3bS,7S,9aR,9bS,11aR)-9a,11a-dimethyl-1-[(2R)-6-methylheptan-2-yl]-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-ol, 200-353-2
Ghose Rule False
Classyfire Kingdom Organic compounds
Topological Polar Surface Area 20.2
Hydrogen Bond Donor Count 1.0
Pfizer 3 75 Rule False
Scaffold Graph Level C1CCC2C(C1)CCC1C3CCCC3CCC21
Np Classifier Class Cholestane steroids
Deep Smiles CCCCC[C@H][C@H]CC[C@@H][C@]5C)CC[C@H][C@H]6CC=C[C@]6C)CC[C@@H]C6)O)))))))))))))))))C)))))C
Heavy Atom Count 28.0
Classyfire Class Steroids and steroid derivatives
Scaffold Graph Node Level C1CCC2C(C1)CCC1C3CCCC3CCC21
Classyfire Subclass Cholestane steroids
Isotope Atom Count 0.0
Molecular Complexity 591.0
Database Name cmaup_ingredients;hmdb_chem_all;imppat_phytochem;npass_chem_all;pubchem
Defined Atom Stereocenter Count 8.0
Uniprot Id P04180, P38571, P19835, O00204, P08842, O75908, P22680, P35610, Q9UBM7, P05108, Q02318, O95477, P02647, Q15392, P08183, Q9UNQ0, P35398, O95992, Q9Y6A2, P00189, Q9NY46, Q13133, P09884, P06766, Q02880, P15207, Q16850, n.a., P37840, P02545, P10275, Q03181, P04150, P9WPP1, Q16236, Q9Y6L6, Q9NPD5, O75874, P51449
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-ol
Prediction Hob 1.0
Class Steroids and steroid derivatives
Veber Rule True
Classyfire Superclass Lipids and lipid-like molecules
Target Id NPT483, NPT668, NPT103
Xlogp 8.7
Superclass Lipids and lipid-like molecules
Subclass Cholestane steroids
Gsk 4 400 Rule False
Molecular Formula C27H46O
Scaffold Graph Node Bond Level C1=C2CCCCC2C2CCC3CCCC3C2C1
Prediction Swissadme 0.0
Inchi Key HVYWMOMLDIMFJA-DPAQBDIFSA-N
Silicos It Class Moderately soluble
Fcsp3 0.925925925925926
Logs -6.773
Rotatable Bond Count 5.0
State Solid
Logd 6.543
Synonyms (3beta,14beta,17alpha)-Cholest-5-en-3-ol, Cholest-5-en-3beta-ol, Cholesterin, (3b,14b,17a)-Cholest-5-en-3-ol, (3Β,14β,17α)-cholest-5-en-3-ol, Cholest-5-en-3b-ol, Cholest-5-en-3β-ol, (3Β)-cholest-5-en-3-ol, (3beta)-Cholest-5-en-3-ol, 3Β-hydroxycholest-5-ene, 3beta-Hydroxycholest-5-ene, 5:6-Cholesten-3β-ol, 5:6-Cholesten-3beta-ol, (-)-Cholesterol, Cholesterine, Cholesterol base H, Cholesteryl alcohol, Cholestrin, Cholestrol, Cordulan, Dastar, Dusoline, Dusoran, Dythol, Fancol CH, Hydrocerin, Kathro, Lanol, Super hartolan, Tegolan, Cholesterol, delta5-Cholesten-3beta-ol, Δ5-Cholesten-3β-ol, cholest-5-en-3beta-ol, cholesterin, cholesterol, cholestrol
Esol Class Poorly soluble
Functional Groups CC=C(C)C, CO
Compound Name Cholesterol
Kingdom Organic compounds
Prediction Hob Swissadme 0.0
Exact Mass 386.355
Formal Charge 0.0
Monoisotopic Mass 386.355
Hydrogen Bond Acceptor Count 1.0
Molecular Weight 386.7
Gi Absorption False
Covalent Unit Count 1.0
Total Atom Stereocenter Count 8.0
Total Bond Stereocenter Count 0.0
Molecular Framework Aliphatic homopolycyclic compounds
Lipinski Rule Of 5 True
Esol -7.400916800000002
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 C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C
Nring 4.0
Np Classifier Biosynthetic Pathway Terpenoids
Defined Bond Stereocenter Count 0.0
Egan Rule False
Taxonomy Direct Parent Cholesterols and derivatives
Np Classifier Superclass Steroids