Introduction：Basic information about CAS 500736-17-4|Demethoxydeacetoxypseudolaric acid B analog, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Demethoxydeacetoxypseudolaric acid B analog |
|---|
| CAS Number | 500736-17-4 | Molecular Weight | 376.400 |
|---|
| Density | 1.4±0.1 g/cm3 | Boiling Point | 665.9±55.0 °C at 760 mmHg |
|---|
| Molecular Formula | C24H30O8 | Melting Point | / |
|---|
| MSDS | / | Flash Point | 238.2±25.0 °C |
|---|
Names
| Name | (1R,7S,8R,9R)-9-[(1E,3E)-4-Carboxy-1,3-pentadien-1-yl]-7-hydroxy-9-methyl-11-oxo-10-oxatricyclo[6.3.2.01,7]tridec-3-ene-4-carboxylic acid |
|---|
| Synonym | More Synonyms |
|---|
BiologicalActivity
| Description | Demethoxydeacetoxypseudolaric acid B analog (Compound 13b) is semi-synthesized by efficient routines from Pseudolaric acid B. It has potent activities against HMEC-1, HL-60, A-549, MB-MDA-468, BEL-7402, HCT116, and Hela cells with IC50s ranging from 0.136 to 1.162 μM[1]. |
|---|
| Related Catalog | Research Areas >>CancerSignaling Pathways >>Others >>Others |
|---|
| References | [1]. Yang SP, et al. Structural modification of an angiogenesis inhibitor discovered from traditional Chinese medicineand a structure-activity relationship study. J Med Chem. 2008 Jan 10;51(1):77-85. |
|---|
Chemical & Physical Properties
| Density | 1.4±0.1 g/cm3 |
|---|
| Boiling Point | 665.9±55.0 °C at 760 mmHg |
|---|
| Molecular Formula | C24H30O8 |
|---|
| Molecular Weight | 376.400 |
|---|
| Flash Point | 238.2±25.0 °C |
|---|
| Exact Mass | 376.152191 |
|---|
| LogP | 1.41 |
|---|
| Vapour Pressure | 0.0±4.6 mmHg at 25°C |
|---|
| Index of Refraction | 1.613 |
|---|
| InChIKey | QPFFEVMIQIJTGZ-PSAKCFHXSA-N |
|---|
| SMILES | CC(=CC=CC1(C)OC(=O)C23CC=C(C(=O)O)CCC2(O)C1CC3)C(=O)O |
|---|
Safety Information
Synonyms
| 1H-4,9a-Ethanocyclohepta[c]pyran-7-carboxylic acid, 3-[(1E,3E)-4-carboxy-1,3-pentadien-1-yl]-3,4,4a,5,6,9-hexahydro-4a-hydroxy-3-methyl-1-oxo-, (3R,4R,4aS,9aR)- |
| (1R,7S,8R,9R)-9-[(1E,3E)-4-Carboxy-1,3-pentadien-1-yl]-7-hydroxy-9-methyl-11-oxo-10-oxatricyclo[6.3.2.0]tridec-3-ene-4-carboxylic acid |
