CAS 30220-46-3|Ingenol
Introduction：Basic information about CAS 30220-46-3|Ingenol, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Ingenol | ||
|---|---|---|---|
| CAS Number | 30220-46-3 | Molecular Weight | 348.433 |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 523.8±50.0 °C at 760 mmHg |
| Molecular Formula | C20H28O5 | Melting Point | 153 °C |
| MSDS | / | Flash Point | 284.7±26.6 °C |
Names
| Name | ingenol |
|---|---|
| Synonym | More Synonyms |
Ingenol BiologicalActivity
| Description | Ingenol is a PKC activator, with a Ki of 30 μM, with antitumor activity. |
|---|---|
| Related Catalog | Natural Products >>Terpenoids and GlycosidesResearch Areas >>Cancer |
| Target | PKC:30 μM (Ki) |
| In Vitro | Ingenol is a PKC activator, with a Ki of 30 μM. Ingenol induces ornithine decarboxylase activity (1, 3 mM), and causes morphological changes (1 mM) in primary mouse epidermal keratinocytes. Ingenol (125 μM, 250 μM, 500 μM, 1 mM) also inhibits cell-cell communication[1]. |
| References | [1]. Hasler CM, et al. Specific binding to protein kinase C by ingenol and its induction of biological responses. Cancer Res. 1992 Jan 1;52(1):202-8. |
Chemical & Physical Properties
| Density | 1.3±0.1 g/cm3 |
|---|---|
| Boiling Point | 523.8±50.0 °C at 760 mmHg |
| Melting Point | 153 °C |
| Molecular Formula | C20H28O5 |
| Molecular Weight | 348.433 |
| Flash Point | 284.7±26.6 °C |
| Exact Mass | 348.193665 |
| PSA | 97.99000 |
| LogP | 2.95 |
| Vapour Pressure | 0.0±3.1 mmHg at 25°C |
| Index of Refraction | 1.625 |
| InChIKey | VEBVPUXQAPLADL-WOVWOYSOSA-N |
| SMILES | CC1=CC23C(=O)C(C=C(CO)C(O)C2(O)C1O)C1C(CC3C)C1(C)C |
Safety Information
| Hazard Codes | Xi: Irritant; |
|---|---|
| Risk Phrases | R38;R41 |
| Safety Phrases | 26-36 |
Synonyms
| (1S,4S,5R,6R,9S,10R,12R,14R)-4,5,6-Trihydroxy-7-(hydroxymethyl)-3,11,11,14-tetramethyltetracyclo[7.5.1.0.0]pentadeca-2,7-dien-15-one |
| 1aa,2a,5b,5ab,6b,8ab,9a,10,10aa-Octahydro-5,5a,6-trihydroxy-4-(hydroxymethyl)-1,1,7,9-tetramethyl-1H-2,8a-methanocyclopenta[a]cyclopropa[e]cyclodecen-11-one |
| (1aR,2S,5R,5aR,6S,8aS,9R,10aR)-5,5a,6-trihydroxy-4-(hydroxymethyl)-1,1,7,9-tetramethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one |
| 1H-2,8a-Methanocyclopenta[a]cyclopropa[e]cyclodecen-11-one, 1a,2,5,5a,6,9,10,10a-octahydro-5,5a,6-trihydroxy-4-(hydroxymethyl)-1,1,7,9-tetramethyl-, (1aR,2S,5R,5aR,6S,8aS,9R,10aR)- |
| (1aR,2S,5R,5aR,6S,8aS,9R,10aR)-1a,2,5,5a,6,9,10,10a-Octahydro-5,5a,6-trihydroxy-4-(hydroxymethyl)-1,1,7,9-tetramethyl-1H-2,8a-methanocyclopenta[a]cyclopropa[e]cyclodecen-11-one |
| ingenol |
| MFCD00056380 |
| 1alpha,2,5,5alpha,6,9,10,10alpha-Octahydro-5,5alpha,6-trihydroxy-4-hydroxymethyl-1,1,7,9,-retramethyl-1H-2,8alpha-m |
| 1A,2,5,5A,6,9,10,10A OCTAHYDRO-5,5A,6-TRIHYDROXY4(HYDROXYMETHYL)1,1,7,9-TETRAMETHYL1H-2,8 AMETHANOCYCLOPENTA[A]CYCLOPROPA[E]CYCLODECEN-11 ONE |
