ALDH3A1-IN-2
ALDH3A1-IN-2 structure
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Common Name | ALDH3A1-IN-2 | ||
|---|---|---|---|---|
| CAS Number | 374635-48-0 | Molecular Weight | 222.24 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C11H14N2O3 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
Use of ALDH3A1-IN-2ALDH3A1-IN-2 (Compound 19) is a potent inhibitor of ALDH3A1 with an IC50 of 1.29 μM. Aldehyde dehydrogenases (ALDHs) are overexpressed in various tumor types including prostate cancer. ALDH3A1-IN-2 has the potential for the research of cancer diseases[1]. |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | ALDH3A1-IN-2 |
|---|
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | ALDH3A1-IN-2 (Compound 19) is a potent inhibitor of ALDH3A1 with an IC50 of 1.29 μM. Aldehyde dehydrogenases (ALDHs) are overexpressed in various tumor types including prostate cancer. ALDH3A1-IN-2 has the potential for the research of cancer diseases[1]. |
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| Related Catalog | |
| References |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Molecular Formula | C11H14N2O3 |
|---|---|
| Molecular Weight | 222.24 |
| InChIKey | GAIBXTKNUDDQMR-UHFFFAOYSA-N |
| SMILES | CCN(CC)c1ccc(C=O)cc1[N+](=O)[O-] |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Antiproliferative activity against human DU145 cells expressing ALDH1A1 assessed as r...
Source: ChEMBL
Target: DU-145
External Id: CHEMBL5049248
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Name: Antiproliferative activity against human LNCaP cells expressing ALDH1A3 assessed as r...
Source: ChEMBL
Target: LNCaP
External Id: CHEMBL5049247
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Name: Antiproliferative activity against human PC-3 cells expressing ALDH1A1 and ALDH3A1 as...
Source: ChEMBL
Target: PC-3
External Id: CHEMBL5049246
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Name: Substrate activity at N-terminal-His6 tagged recombinant human ALDH1A1 at 10 uM in pr...
Source: ChEMBL
Target: Aldehyde dehydrogenase 1A1
External Id: CHEMBL5049237
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Name: Inhibition of N-terminal-His6 tagged recombinant human ALDH3A1 assessed as reduction ...
Source: ChEMBL
Target: Aldehyde dehydrogenase, dimeric NADP-preferring
External Id: CHEMBL5049236
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This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular formula of ALDH3A1-IN-2? |
| A: Molecular formula of ALDH3A1-IN-2 is C11H14N2O3. |
| Q: What is the CAS number of ALDH3A1-IN-2? |
| A: CAS number of ALDH3A1-IN-2 is 374635-48-0. |
| Q: What is the SMILES notation of ALDH3A1-IN-2? |
| A: SMILES notation of ALDH3A1-IN-2 is CCN(CC)c1ccc(C=O)cc1[N+](=O)[O-]. |
| Q: What is the InChIKey of ALDH3A1-IN-2? |
| A: InChIKey of ALDH3A1-IN-2 is GAIBXTKNUDDQMR-UHFFFAOYSA-N. |
| Q: What is the English name of ALDH3A1-IN-2? |
| A: The English name of ALDH3A1-IN-2 is ALDH3A1-IN-2. |
| Q: What is the Chinese name of 374635-48-0? |
| A: Chinese name of 374635-48-0 is 374635-48-0. |
| Q: What is the molecular weight of ALDH3A1-IN-2? |
| A: Molecular weight of ALDH3A1-IN-2 is 222.24. |
| Q: What are the uses of ALDH3A1-IN-2? |
| A: Main uses of ALDH3A1-IN-2: ALDH3A1-IN-2 (Compound 19) is a potent inhibitor of ALDH3A1 with an IC50 of 1.29 μM. Aldehyde dehydrogenases (ALDHs) are overexpressed in various tumor types including prostate cancer. ALDH3A1-IN-2 has the potential for the research of cancer diseases[1]. |