
CAS Number6900-87-4
SynonymsJapaconitine C1; HYPACONITINE (PRIMARY STANDARD); Japaconitine B1; DEOXYMESACONITINE; 15-tetraol,16,16-trimethoxy-4-(methoxymethyl)-20-methyl-18-aconitane-14; Japaconitine C
Molecular FormulaC33H45NO10
Molecular Weight615.72
Purity98.00%
Density1.4±0.1 g/cm3
Boiling Point671.3±55.0 °C at 760 mmHg
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 6900-87-4 |
| Catalog No. | 2A-9033220 |
| Chinese Name | 次乌头碱 |
| Synonyms | Japaconitine C1; HYPACONITINE (PRIMARY STANDARD); Japaconitine B1; DEOXYMESACONITINE; 15-tetraol,16,16-trimethoxy-4-(methoxymethyl)-20-methyl-18-aconitane-14; Japaconitine C |
| Molecular Formula | C33H45NO10 |
| Molecular Weight | 615.72 |
| Purity | 98.00 |
| Density | 1.4±0.1 g/cm3 |
| Boiling Point | 671.3±55.0 °C at 760 mmHg |
| Storage Condition | The warehouse is low-temperature, ventilated, dry, |
| Packaging | I |
| Application | Hypaconitine is a highly toxic natural active ingredient isolated from Aconitum species and is widely used in the treatment of rheumatism. |
| HTC | 29399990 |
| MDL Number | C33H45NO10 |
| SMILES | COCC12CCC(OC)C34C5CC6(O)C(OC)C(O)C(OC(C)=O)(C5C6OC(=O)c5ccccc5)C(C(OC)C13)C4N(C)C2 |
| InChI | InChI=1S/C33H45NO10.BrH/c1-17(35)44-33-21-19(14-31(38,28(42-6)26(33)36)27(21)43-29(37)18-10-8-7-9-11-18)32-20(40-4)12-13-30(16-39-3)15-34(2)25(32)22(33)23(41-5)24(30)32;/h7-11,19-28,36,38H,12-16H2,1-6H3;1H/t19-,20?,21-,22?,23?,24-,25-,26?,27?,28+,30?,31-,32?,33-;/m1./s1 |
| InChI Key | FIDOCHXHMJHKRW-XABIWAOFSA-N |
| Hazard Symbols | 6.1(a) |
| MSDS | msds/33220_1_6900_87_4.pdf |
| Transport Info | Product Name: Hypoconitine |
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