| 2D Structure | |
| CID | 222284 |
| Target | F2 , F2-coagulation factor II, thrombin (human) , GSK3B , PRKAA1 , PRKAA2 , PRKAB1 , PRKAB2 , PRKAG1 , PRKAG2 , PRKAG3 |
| IUPAC Name | (3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol |
| InChI | InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,19-21,23-27,30H,7-9,11-18H2,1-6H3/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1 |
| InChI Key | KZJWDPNRJALLNS-VJSFXXLFSA-N |
| Canonical SMILES | CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C |
| Isomeric SMILES | CC[C@H](CC[C@@H](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)C(C)C |
| Molecular Formula | C29H50O |
| Molecular Weight | 414.7 |
| synonyms | ['BETA-SITOSTEROL', 'Sitosterol', 'Cupreol', 'Azuprostat', 'Quebrachol', '22,23-Dihydrostigmasterol', 'Cinchol', 'Triastonal', 'Rhamnol', 'beta-Sitosterin', 'Nimbosterol', 'Prostasal', 'alpha-Dihydrofucosterol', 'Sito-Lande', '24alpha-Ethylcholesterol', 'beta Sitosterol', 'Stigmast-5-en-3beta-ol', '(24R)-Ethylcholest-5-en-3beta-ol', 'alpha-Phytosterol', 'Angelicin (steroid)', 'sitosterin', '(3beta)-Stigmast-5-en-3-ol', 'Betaprost', '(24R)-Stigmast-5-en-3beta-ol', 'Beta-sistosterol', 'SITOSTEROL, BETA-', 'SKF 14463', 'SITOSTEROL, BETA', 'CHEBI:27693', 'NSC8096', '24-alpha-Ethylcholesterol', 'Stigmast-5-en-3-ol, (3beta)-', 'UNII-S347WMO6M4', 'delta5-Stigmasten-3-beta-ol', 'CCRIS 5529', 'S347WMO6M4', 'DTXSID5022481', 'Stigmasterol, 22,23-dihydro-', '(3-beta)-Stigmast-5-en-3-ol', 'NSC 8096', 'NSC-8096', 'EINECS 201-480-6', 'NSC 18173', 'NSC-18173', 'NSC-49083', 'AI3-26020', 'DTXCID802481', 'NSC18173', 'SITOSTEROL (MART.)', 'SITOSTEROL [MART.]', 'BETA-SITOSTEROL (USP-RS)', 'BETA-SITOSTEROL [USP-RS]', '5-Stigmasten-3beta-ol', 'I2-sitosterol', 'Beta-Sitosterol-2', '3 beta-stigmast-5-en-3-ol', '5-cholesten-24-ethyl-3-ol', 'delta(SUP 5)-STIGMASTEN-3beta-OL', 'beta-SITOSTEROL (CONSTITUENT OF PYGEUM)', '24beta-ETHYL-delta(SUP 5)-CHOLESTEN-3beta-OL', 'BETA-SITOSTEROL (CONSTITUENT OF SAW PALMETTO)', 'Corn sterilized quantitative extract (beta sitosterol)', 'BETA-SITOSTEROL (CONSTITUENT OF STINGING NETTLE)', '201-480-6', 'beta-SITOSTEROL (CONSTITUENT OF ECHINACEA ANGUSTIFOLIA ROOT, ECHINACEA PALLIDA ROOT, ECHINACEA PURPUREA ROOT AND ECHINACEA PURPUREA AERIAL PARTS)', '83-46-5', 'Harzol', '(-)-beta-Sitosterol', 'B-Sitosterol', 'Sobatum', 'a-Dihydrofucosterol', '.alpha.-Dihydrofucosterol', 'CHEMBL221542', '.beta.-Sitosterol', 'NSC49083', '.alpha.-Phytosterol', 'Sitosterol, .beta.', '(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol', 'b-Sitosterol (Synthetic)', 'Stigmasterol,23-dihydro-', '.beta.-Sitosterin', 'MFCD00003631', 'Stigmast-5-en-3-ol, (3.beta.)-', '24.alpha.-Ethylcholesterol', 'Stigmast-5-en-3-ol, (3b)-', 'Stigmast-5-en-3.beta.-ol', 'SR-05000002307', 'Beta-Sitosterol (purity>98%)', 'Stigmast-5-en-3-beta-ol', 'Sitosterol beta', 'a-Phytosterol', 'b-Sitosterin', 'beta-Phytosterol', 'ss--Sitosterol', '.beta.Sitosterin', '.beta.Sitosterol', 'beta -Sitosterol', 'CAS-83-46-5', 'NCGC00095716-01', '(3S,8S,9S,10R,13R,14S,17R)-17-[(1R,4R)-4-ethyl-1,5-dimethyl-hexyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol', '(-)-b-Sitosterol', 'Harzol (TN)', '24a-Ethylcholesterol', 'alpha.Dihydrofucosterol', 'D5-Stigmasten-3b-ol', 'Stigmast-5-en-3b-ol', 'b-Sitosterol - 40%', 'b-Sitosterol - 80%', 'Prestwick0_000985', 'Prestwick1_000985', 'Prestwick2_000985', 'Prestwick3_000985', '?-Sitosterol - 70%', 'Delta5-Stigmasten-3b-ol', 'beta-Sitosterol, >=70%', 'Beta-Sitosterol (Standard)', 'Beta-sitosterol [WHO-DD]', 'BIDD:PXR0121', 'SCHEMBL16105', '22,23-dihydro-Stigmasterol', 'BSPBio_001049', 'BIDD:ER0636', 'SPBio_002950', 'BPBio1_001155', 'MEGxp0_001710', 'BETA SITOSTEROL [VANDF]', '.BETA.-SITOSTEROL [MI]', '(24R)-Stigmast-5-en-3b-ol', 'ACon1_000287', 'HY-N0171R', 'CHEBI:176889', 'HMS1571E11', 'HMS2098E11', '(24R)-Ethylcholest-5-en-3b-ol', '24-Ethylcholest-5-en-3.beta.-ol', 'MSK40101', 'beta-Sitosterol, analytical standard', 'Tox21_111514', 'BDBM50218197', 'beta-Sitosterol, synthetic, >=95%', 'LMST01040129', 'NSC821067', 's2273', 'AKOS005267194', 'AT37227', 'BETA-SITOSTEROL, 40% (HPLC)', 'CCG-208334', 'DB14038', 'FS12899', 'FS16412', 'FS29792', 'NSC-821067', 'beta-Sitosterol, from soybean, >=96%', 'SMP1_000274', 'NCGC00142598-02', 'NCGC00142598-03', 'NCGC00142598-08', '(3.BETA.)-STIGMAST-5-EN-3-OL', '(3S,8S,9S,10R,13R,14S,17R)-17-((2R,5R)-5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol', '14-((1S,4R)-4-ethyl-1,5-dimethylhexyl)(1S,5S,10S,11S,2R,14R,15R)-2,15-dimethyl tetracyclo[8.7.0.0<2,7>.0<11,15>]heptadec-7-en-5-ol', '1ST40101', 'AC-24183', 'BP-40650', 'NCI60_041777', 'AB00513984', 'NS00078818', 'S0040', '.DELTA.(SUP 5)-STIGMASTEN-3.BETA.-OL', 'C01753', 'D08518', 'A840577', 'AA-504/07226009', 'alpha-Dihydrofucosterol, 22,23-Dihydrostigmasterol', 'SR-05000002307-2', 'SR-05000002307-3', 'BRD-K79402892-001-06-7', 'Q63409374', '.BETA.-SITOSTEROL (CONSTITUENT OF PYGEUM) [DSC]', 'BETA-SITOSTEROL (CONSTITUENT OF SAW PALMETTO) [DSC]', 'BETA-SITOSTEROL, inverted exclamation markY 98% (HPLC)', 'beta-Sitosterol, analytical standard, from soybean, >=40%', 'beta-Sitosterol, primary pharmaceutical reference standard', '24.BETA.-ETHYL-.DELTA.(SUP 5)-CHOLESTEN-3.BETA.-OL', 'BETA-SITOSTEROL (CONSTITUENT OF STINGING NETTLE) [DSC]', 'Beta-sitosterol, European Pharmacopoeia (EP) Reference Standard', '-Sitosterol (purity>98%);22,23-Dihydrostigmasterol (purity>98%)', 'beta-Sitosterol, United States Pharmacopeia (USP) Reference Standard', 'beta-Sitosterol, certified reference material, 100 mug/mL in chloroform', '17-(5-ethyl-6-methyl-heptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol', '76772-70-8'] |
From Pubchem