PRODUCT Properties
| Melting point: | 141-143°C |
| storage temp. | Sealed in dry,2-8°C |
| solubility | insoluble in H2O; ≥16 mg/mL in DMSO; ≥2.95 mg/mL in EtOH with gentle warming and ultrasonic |
| form | powder to crystal |
| Boiling point: | 482.9±45.0 °C(Predicted) |
| Density | 1.23±0.1 g/cm3(Predicted) |
| pka | 6.53±0.20(Predicted) |
| color | White to Light yellow |
| λmax | 280nm(lit.) |
| Major Application | metabolomics vitamins, nutraceuticals, and natural products |
| Cosmetics Ingredients Functions | SKIN CONDITIONING - MISCELLANEOUS HAIR CONDITIONING |
| InChI | 1S/C21H25NO4/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4/h5-6,10-11,17H,7-9,12H2,1-4H3/t17-/m0/s1 |
| InChIKey | AEQDJSLRWYMAQI-KRWDZBQOSA-N |
| SMILES | COC1=CC=C2C(CN(CCC3=C4C=C(OC)C(OC)=C3)[C@@]4([H])C2)=C1OC |
| CAS DataBase Reference | 483-14-7 |
Description and Uses
Rotundine is an analgesic drug found in Chinese herbal medicine, used to treat heart disease and liver damage.
Safety
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H315-H319-H227 |
| Precautionary statements | P501-P210-P264-P280-P302+P352-P370+P378-P337+P313-P305+P351+P338-P362+P364-P332+P313-P403+P235 |
| WGK Germany | WGK 3 |
| RTECS | HQ1792500 |
| HS Code | 2933.99.9000 |
| Storage Class | 11 - Combustible Solids |
