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| Name |
Magnoflorine |
EINECS | N/A |
| CAS No. | 2141-09-5 | Density | g/cm3 |
| PSA | 58.92000 | LogP | 2.97050 |
| Solubility | N/A | Melting Point |
252oC |
| Formula | C20H24NO4 | Boiling Point | °Cat760mmHg |
| Molecular Weight | 469.31 | Flash Point | °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
4H-Dibenzo[de,g]quinolinium,5,6,6a,7-tetrahydro-1,11-dihydroxy-2,10-dimethoxy-6,6-dimethyl-, (S)-;6aa-Aporphinium,1,11-dihydroxy-2,10-dimethoxy-6-methyl- (8CI);(+)-Magnoflorine;Escholin;Escholine;Thalictrin;Thalictrine;a-Magnoflorine; |
Magnoflorine Chemical Properties
Product Name: Magnoflorine
Molecular Structure of Magnoflorine (CAS NO.2141-09-5):
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Molecular Formula: C20H24NO4
Molecular Weight: 342.4083
Synonyms of Magnoflorine (CAS NO.2141-09-5): ( )-Magnoflorine ; 6a-alpha-Aporphinium, 1,11-dihydroxy-2,10-dimethoxy-6-methyl- ; Escholin ; Escholine ; Thalictrin ; Thalictrine ; 4H-Dibenzo(de,g)quinolinium, 5,6,6a,7-tetrahydro-1,11-dihydroxy-2,10-dimethoxy-6,6-dimethyl-,(6aS)-
CAS NO: 2141-09-5
Classification Code: Natural Product
H bond acceptors: 5
H bond donors: 2
Freely Rotating Bonds: 4
Polar Surface Area of Magnoflorine (CAS NO.2141-09-5): 36.92 Å2
SMILES: Oc2c4c1c(O)c(OC)ccc1C[C@H]3c4c(cc2OC)CC[N+]3(C)C
InChI: InChI=1/C20H23NO4/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23)/p+1/t13-/m0/s1
InChIKey: YLRXAIKMLINXQY-VVNSCHGPBP
Std. InChI: InChI=1S/C20H23NO4/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23)/p+1/t13-/m0/s1
Std. InChIKey: YLRXAIKMLINXQY-ZDUSSCGKSA-O
Magnoflorine Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intraperitoneal | 19600ug/kg (19.6mg/kg) | Journal of Ethnopharmacology. Vol. 4, Pg. 247, 1981. | |
| mouse | LD50 | intravenous | 20mg/kg (20mg/kg) | Journal of Ethnopharmacology. Vol. 4, Pg. 247, 1981. | |
| mouse | LD50 | subcutaneous | 138mg/kg (138mg/kg) | Journal of Ethnopharmacology. Vol. 4, Pg. 247, 1981. |
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