| Phytochemical Name : Ursolic Acid |
| PCNDIDU0011 |
| Pubchem CID : 64945 |
| Molecular formula: C30H48O3 |
| Canonical SMILES : CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O |
Synonymes : Ursolic acid|77-52-1|Prunol|Malol|Urson|3beta-Hydroxyurs-12-en-28-oic acid|Micromerol|(3beta)-3-Hydroxyurs-12-en-28-oic acid|NSC-4060|CCRIS 7123|CHEBI:9908|NSC 167406|ursolic-acid|NSC 4060|EINECS 201-034-0|NSC-167406|UNII-P3M2575F3F|(+)-Ursolic acid|AI3-03109|HSDB 7685|P3M2575F3F|CHEMBL169|Urs-12-en-28-oic acid, 3beta-hydroxy-|Urs-12-en-28-oic acid, 3-hydroxy-, (3beta)-|.beta.-Ursolic acid|3B-HYDROXYURS-12-EN-28-OIC ACID|(3 beta)-3-hydroxyurs-12-en-28-oic acid|Bungeolic acid|URSOLIC ACID (USP-RS)|URSOLIC ACID [USP-RS]|3beta-Hydroxy-12-ursen-28-ic acid|NSC4060|Prunol;Urson;Malol|MFCD00009621|Urs-12-en-28-oic acid, 3-hydroxy-, (3.beta.)-|SMR000445681|3beta-hydroxyurs-12-en-28-syre|SR-01000779684|(1S,2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid|(3-beta)-3-Hydroxyurs-12-en-28-oic acid|Merotaine|TNP00103|3b - hydroxyurs - 12 - en - 28 - oic acid|6Q5|Prestwick3_000089|Ursolic acid, >=90%|D07LUJ|URSOLIC ACID [MI]|URSOLIC ACID [HSDB]|URSOLIC ACID [INCI]|SCHEMBL70205|BSPBio_000018|MLS000728569|MLS002154196|MLS002207073|URSOLIC ACID [WHO-DD]|BPBio1_000020|N-Ethylhydroxylaminehydrochloride|DTXSID70883221|Ursolic acid, analytical standard|3beta-Hydroxyurs-12-en-28-oate|HMS2095A20|HMS2231P19|(1S,2R,4aS,6aS,6bR,8aR,10S,12aR,12bR,14bS)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid|3beta-hydroxy-Urs-12-en-28-oate|HY-N0140|BDBM50148911|3beta-Hydroxy-12-ursen-28-oic Acid|AKOS005228010|AKOS016023773|3.beta.-hydroxy-Urs-12-en-28-oate|CCG-208282|CS-3799|DB15588|LMPR0106180007|(3beta)-3-Hydroxyurs-12-en-28-oate|3beta-hydroxy-Urs-12-en-28-oic acid|(3beta)-3-hydroxy-Urs-12-en-28-oate|AS-35119|3.beta.-hydroxy-Urs-12-en-28-oic acid|LS-160850|(3beta)-3-hydroxy-Urs-12-en-28-oic acid|AB00513802|U0065|C08988|A839123|Q416260|Q-201916|SR-01000779684-4|SR-01000779684-5|(3.BETA.)-3-HYDROXYURS-12-EN-28-OIC ACID|BRD-K68185022-001-02-3|BRD-K68185022-001-14-8|URSOLIC ACID (CONSTITUENT OF HOLY BASIL LEAF)|Ursolic acid, primary pharmaceutical reference standard|AF479D19-631E-48F1-8ABA-FB2A806046FA|URSOLIC ACID (CONSTITUENT OF HOLY BASIL LEAF) [DSC]|Ursolic acid, European Pharmacopoeia (EP) Reference Standard|Ursolic acid, United States Pharmacopeia (USP) Reference Standard|(1S,2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylicacid |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.710 |
| Log Po/w (XLOGP3) : 7.340 |
| Log Po/w (WLOGP) : 7.090 |
| Log Po/w (MLOGP) : 5.820 |
| Log Po/w (SILICOS-IT) : 5.460 |
| Consensus Log Po/w : 5.880 |