| Phytochemical Name : Pachymic acid |
| PCNDIDP0003 |
| Pubchem CID : 5484385 |
| Molecular formula: C33H52O5 |
| Canonical SMILES : CC(C)C(=C)CCC(C1C(CC2(C1(CCC3=C2CCC4C3(CCC(C4(C)C)OC(=O)C)C)C)C)O)C(=O)O |
Synonymes : Pachymic acid|29070-92-6|3-O-Acetyltumulosic acid|UNII-X2FCK16QAH|X2FCK16QAH|CCRIS 7792|Lanost-8-en-21-oic acid, 3-(acetyloxy)-16-hydroxy-24-methylene-, (3beta,16alpha)-|CHEMBL468034|CHEBI:80885|C33H52O5|NSC 244427|NSC-244427|Pachymic-acid|HY-N0371|BDBM50292363|MFCD00238657|(3b,16a)-3-(Acetyloxy)-16-hydroxy-24-methylenelanost-8-en-21-oic acid|AKOS030526129|CS-5368|AC-33955|BS-42182|C17044|A912692|Q-100369|EBURICA-8,24(28)-DIEN-21-OIC ACID, 3.BETA.,16.ALPHA.-DIHYDROXY-, 3-ACETATE|LANOST-8-EN-21-OIC ACID, 3.BETA.,16.ALPHA.-DIHYDROXY-24-METHYLENE-, 3-ACETATE|LANOST-8-EN-21-OIC ACID, 3-(ACETYLOXY)-16-HYDROXY-24-METHYLENE-, (3.BETA.,16.ALPHA.)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 4.190 |
| Log Po/w (XLOGP3) : 7.230 |
| Log Po/w (WLOGP) : 7.330 |
| Log Po/w (MLOGP) : 5.330 |
| Log Po/w (SILICOS-IT) : 6.810 |
| Consensus Log Po/w : 6.180 |