Basic Information | Post buying leads | Suppliers |
Name |
Daipin |
EINECS | N/A |
CAS No. | 18067-13-5 | Density | g/cm3 |
PSA | N/A | LogP | N/A |
Solubility | N/A | Melting Point |
N/A |
Formula | C18H24NO4•CH3O4S | Boiling Point | °Cat760mmHg |
Molecular Weight | 429.53 | Flash Point | °C |
Transport Information | N/A | Appearance | N/A |
Safety | Poison by intravenous and intraperitoneal routes. Moderately toxic by ingestion and subcutaneous routes. Experimental reproductive effects. When heated to decomposition it emits toxic fumes of SOx and NOx. | Risk Codes | N/A |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
N/A |
Product Name: Daipin (CAS NO.18067-13-5)
Molecular Formula: C18H24NO4•CH3O4S
Molecular Weight: 429.53g/mol
Mol File: 18067-13-5.mol
H-Bond Donor: 1
H-Bond Acceptor: 8
Structure Descriptors of Daipin (CAS NO.18067-13-5):
Canonical SMILES: C[N+]1(C2CC(CC1C3C2O3)OC(=O)C(CO)C4=CC=CC=C4)C.COS(=O)(=O)[O-]
Isomeric SMILES: C[N+]1([C@@H]2CC(C[C@H]1C3C2O3)OC(=O)[C@H](CO)C4=CC=CC=C4)C.COS(=O)(=O)[O-]
InChI: InChI=1S/C18H24NO4.CH4O4S/c1-19(2)14-8-12(9-15(19)17-16(14)23-17)22-18(21)13(10-20)11-6-4-3-5-7-11;1-5-6(2,3)4/h3-7,12-17,20H,8-10H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1/t12?,13-,14-,15+,16?,17?;/m1./s1
InChIKey: KHMGIQHRSVLFQG-UFBPGTJLSA-M
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 116mg/kg (116mg/kg) | Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 4, Pg. 90, 1973. | |
mouse | LD50 | intravenous | 36900ug/kg (36.9mg/kg) | Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 4, Pg. 90, 1973. | |
mouse | LD50 | oral | 3010mg/kg (3010mg/kg) | Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 4, Pg. 90, 1973. | |
mouse | LD50 | subcutaneous | 558mg/kg (558mg/kg) | Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 4, Pg. 90, 1973. | |
rat | LD50 | intraperitoneal | 212mg/kg (212mg/kg) | Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 4, Pg. 90, 1973. | |
rat | LD50 | intravenous | 56800ug/kg (56.8mg/kg) | Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 4, Pg. 90, 1973. | |
rat | LD50 | oral | 5590mg/kg (5590mg/kg) | Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 4, Pg. 90, 1973. | |
rat | LD50 | subcutaneous | 1340mg/kg (1340mg/kg) | Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 4, Pg. 90, 1973. |
Poison by intravenous and intraperitoneal routes. Moderately toxic by ingestion and subcutaneous routes. Experimental reproductive effects. When heated to decomposition it emits toxic fumes of SOx and NOx.
Daipin ,its CAS NO. is 18067-13-5,the synonyms is (S)-6beta,7beta-Epoxy-8-methyl-3alpha-(-)-tropoyloxy-1alphaH,5alphaH-tropanium-methylsulfat ; CERM 1290 ; DD 234 ; EINECS 241-975-4 ; Espasmo gasium ; Methylscopolamine methyl sulfate ; Methylscopolammonium methylsulfate ; N-Methylhyoscin methylsulfat ; N-Methylscopolaminium methylsulfat ; Sandrix ; Ulix ; Vitasterin ; (7(S)(1alpha2beta,4beta,5alpha,7beta))-7-(3-Hydroxy-1-oxo-2-phenylpropoxy)-9,9-dimethyl-3-oxa-9-azoniatricyclo(3.3.1.02,4)nonane methyl sulphate ; 1-alpha-H,5-alpha-H-Tropanium, 6-beta,7-beta-epoxy-3-alpha-hydroxy-8-methyl-, methyl sulfate, (-)-tropate .