Alkaloids
SODIUM ARISTOLOCHATE
马兜铃酸钠
PHY-NP-10067 · Natural product research catalog
| Catalog number | PHY-NP-10067 |
|---|---|
| CAS number | 10190-99-5 |
| Molecular formula | C17H10NNaO7 |
| Molecular weight | 363.257 g/mol |
| Chemical class | Alkaloids |
| Main reported source | Aristolochia kaempferi |
| Purity / assay | Min. 98% Other purity specifications available on inquiry. |
Chemical structure
Select a pack size
| Pack | Price (USD) | Availability | Lead time |
|---|---|---|---|
| 5 mg | Request quote | To be confirmed | Confirm in quotation |
| 10 mg | Request quote | To be confirmed | Confirm in quotation |
| 20 mg | Request quote | To be confirmed | Confirm in quotation |
| 50 mg | Request quote | To be confirmed | Confirm in quotation |
| 100 mg | Request quote | To be confirmed | Confirm in quotation |
Final specifications and availability are confirmed in your quotation. No purchase or reservation is made here.
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Product information
SODIUM ARISTOLOCHATE is listed in the Alkaloids section of the Phytide Bio research catalog. Standard pack sizes are 5, 10, 20, 50 and 100 mg.
For research use only. Not for human or veterinary use, diagnosis or treatment.
Names & identifiers
| IUPAC name | sodium 8-methoxy-6-nitronaphtho[2,1-g][1,3]benzodioxole-5-carboxylate |
|---|---|
| SMILES | COc1cccc2c1cc([N+](=O)[O-])c1c(C(=O)[O-])cc3c(c12)OCO3.[Na+] |
| InChIKey | BQVOPWJSBBMGBR-UHFFFAOYSA-M |
| Subclass / scaffold | Tyrosine alkaloids：Aporphine alkaloids |
| PubChem CID | 154914 |
Computed properties
| Exact mass (Da) | 363.0355 | Predicted LogP | 3.3367 |
|---|---|---|---|
| Predicted TPSA (Ų) | 108.13 | H-bond donors | 1 |
| H-bond acceptors | 6 | Rotatable bonds | 3 |
Calculated values from the supplied dataset; not measured batch specifications.
View additional properties & classification
| Ring count | 4 |
|---|---|
| Aromatic rings | 3 |
| Fraction Csp³ | 0.118 |
| Synthetic accessibility score | 2.58 |
| QED score | 0.442 |
| Lipinski rule violations | 0 |
| NPClassifier pathway | Alkaloids |
| NPClassifier superclass | Tyrosine alkaloids |
| NPClassifier class | Aporphine alkaloids |
| Parent SMILES | COc1cccc2c1cc([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3 |
| Parent formula | C17H11NO7 |
| Parent molecular weight | 341.275 |
| Specified stereocenters | 0 |
| Unspecified stereocenters | 0 |
Reported natural occurrence
| Main reported source | Aristolochia kaempferi |
|---|---|
| Reported source families | Aristolochiaceae; Menispermaceae; Papilionidae |
Reported natural occurrence does not establish the manufacturing origin of the supplied material.
View occurrence records & references
| LOTUS / Wikidata species | Aristolochia kaempferi[10]; Aristolochia clematitis[6]; Aristolochia debilis[6]; Aristolochia fangchi[6]; Aristolochia manshuriensis[6]; Aristolochia mollissima[6]; Aristolochia kwangsiensis[5]; Aristolochia argentina[4]; Aristolochia baetica[4]; Aristolochia elegans[4]; Aristolochia fontanesii[4]; Aristolochia heterophylla[4]; Aristolochia indica[4]; Aristolochia littoralis[4]; Aristolochia maurorum[4] |
|---|---|
| All reported source families | Aristolochiaceae[56]; Menispermaceae[3]; Papilionidae[1] |
| Genus / family records | Aristolochia[1] |
| LOTUS species records | 59 |
| LOTUS reference records | 48 |
| COCONUT occurrence records | Akebia quinata; Akebia trifoliata; Amomum giganteum; Aristolochia; Aristolochia Indica; Aristolochia Kaempferi; Aristolochia acuminata; Aristolochia albida; Aristolochia argentina; Aristolochia auricularia; Aristolochia baetica; Aristolochia bodamae; Aristolochia bracteolata; Aristolochia chamissonis; Aristolochia championii; Aristolochia chilensis; Aristolochia cinnabarina; Aristolochia cinnarbarina; Aristolochia clematis; Aristolochia clematitis; Aristolochia clematitis L.; Aristolochia constricta; Aristolochia contorta; Aristolochia cucurbitifolia; Aristolochia debilis; Aristolochia didyma; Aristolochia elegans; Aristolochia esperanzae; Aristolochia fangchi; Aristolochia fimbriata |
| COCONUT organism records | 96 |
| COCONUT identifier | CNP0490967.0 |
| Source reference DOI(s) | 10.1007/978-1-4615-8819-1_17 |
Records are inherited from the supplied dataset and are not independently verified. Taxonomic names may include synonyms.
Documents & specifications
| Certificate of analysis (COA) | Batch-specific COA available on request; no PDF published yet |
|---|---|
| Safety data sheet (SDS) | Not yet published |
| Storage / solubility | Product-specific conditions to be confirmed |
| Shipping | Confirmed with the quotation |
Request applicable documentation and handling information before ordering or use.
