15-Oxosparteine
15-Oxosparteine structure
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Common Name | 15-Oxosparteine | ||
|---|---|---|---|---|
| CAS Number | 550-90-3 | Molecular Weight | 412.734 | |
| Density | 0.9±0.1 g/cm3 | Boiling Point | 457.4±12.0 °C at 760 mmHg | |
| Molecular Formula | C30H52 | Melting Point | 40-44° | |
| MSDS | N/A | Flash Point | 221.8±13.1 °C | |
Use of 15-OxosparteineLupanin (D-Lupanine) is a natural ketonic derivative of Sparteine ((+)-Sparteine (HY-W008350)) with a ganglioplegic activity. Lupanine shows binding affinity for nicotinic receptor (nAChR) with a Ki value of 500 nM[1]. |
Summary: Lupanine (Chinese name: 羽扇豆鹼), CAS number: 550-90-3, has a molecular formula of C30H52 and a molecular weight of 412.734. It appears as an oily substance with a melting point of 40-44°C, boiling point of 457.4±12.0 °C, and a density of 0.9±0.1 g/cm3. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | lupanine |
|---|---|
| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | Lupanin (D-Lupanine) is a natural ketonic derivative of Sparteine ((+)-Sparteine (HY-W008350)) with a ganglioplegic activity. Lupanine shows binding affinity for nicotinic receptor (nAChR) with a Ki value of 500 nM[1]. |
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| Related Catalog | |
| Target |
Ki: 500 nM (Nicotinic receptor) and 11000 nM (Muscarinic receptor)[1] |
| In Vitro | Lupanine 对烟碱受体具有结合亲和力，Ki 值为 500 nM。而 Lupanine 对毒蕈碱受体的亲和力非常弱，Ki 值为 11000 nM[1]。 |
| In Vivo | Lupanine (腹腔注射 100-300 毫克/千克；口服 175-700 毫克/千克) 在 EOPS 雄性瑞士小鼠 (20-22 克) 和哈特利豚鼠 (400-500 克) 中单次注射的毒性要小得多 [1]。 Lupanine (1-7.5 mg/kg；i.v.) 比 Sparteine 更有效地对抗颈动脉闭塞引起的继发性反射性高血压和刺激肺胃神经引起的猫狗低血压[1]。 Lupanine 对阿托品治疗的狗注射乙酰胆碱 (500 pg/kg i.v.) 引起的烟碱型高血压有抑制作用[1]。 |
| References |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 0.9±0.1 g/cm3 |
|---|---|
| Boiling Point | 457.4±12.0 °C at 760 mmHg |
| Melting Point | 40-44° |
| Molecular Formula | C30H52 |
| Molecular Weight | 412.734 |
| Flash Point | 221.8±13.1 °C |
| Exact Mass | 412.406891 |
| PSA | 23.55000 |
| LogP | 13.33 |
| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
| Index of Refraction | 1.498 |
| InChIKey | JYIJIIVLEOETIQ-XDQVBPFNSA-N |
| SMILES | O=C1CCCC2C3CC(CN12)C1CCCCN1C3 |
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi |
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This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
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| DownStream 1 | |
CAS#:17026-42-5
CAS#:15358-48-2
CAS#:10034-85-2
CAS#:90-39-1This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 2-oxosparteine |
| (7a,7aa,14a,14ab)-Dodecahydro-7,14-methano-4H,6H-dipyrido[1,2-a:1',2'-e][1,5]diazocin-4-one |
| Lupane |
| 3-Pyrrolidinecarboxylic acid,2-oxo |
| Spartein-15-one |
| 2-OXO-3-PYRROLIDINECARBOXYLIC ACID |
| 15-Oxosparteine |
| 2-OXO-PYRROLIDINE-3-CARBOXYLIC ACID |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the downstream products of lupanine? |
| A: Related downstream products(CAS) of lupanine: 90-39-1. |
| Q: What is the SMILES notation of lupanine? |
| A: SMILES notation of lupanine is O=C1CCCC2C3CC(CN12)C1CCCCN1C3. |
| Q: What is the molecular formula of lupanine? |
| A: Molecular formula of lupanine is C30H52. |
| Q: What is the CAS number of lupanine? |
| A: CAS number of lupanine is 550-90-3. |
| Q: What is the InChIKey of lupanine? |
| A: InChIKey of lupanine is JYIJIIVLEOETIQ-XDQVBPFNSA-N. |
| Q: What is the LogP of lupanine? |
| A: LogP of lupanine is 13.33. |
| Q: What are the uses of lupanine? |
| A: Main uses of lupanine: Lupanin (D-Lupanine) is a natural ketonic derivative of Sparteine ((+)-Sparteine (HY-W008350)) with a ganglioplegic activity. Lupanine shows binding affinity for nicotinic receptor (nAChR) with a Ki value of 500 nM[1]. |
| Q: What is the boiling point of lupanine? |
| A: Boiling point of lupanine is 457.4±12.0 °C at 760 mmHg. |
| Q: What is the polar surface area (PSA) of lupanine? |
| A: Polar surface area (PSA) of lupanine is 23.55000. |
| Q: What English synonyms does lupanine have? |
| A: English synonyms of lupanine: 2-oxosparteine, (7a,7aa,14a,14ab)-Dodecahydro-7,14-methano-4H,6H-dipyrido[1,2-a:1',2'-e][1,5]diazocin-4-one, Lupane, 3-Pyrrolidinecarboxylic acid,2-oxo, Spartein-15-one, 2-OXO-3-PYRROLIDINECARBOXYLIC ACID, 15-Oxosparteine, 2-OXO-PYRROLIDINE-3-CARBOXYLIC ACID. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| BioBioPha |
| Dayang Chem (Hangzhou) Co., Ltd. |