- 中文别名:卡那霉素B硫酸盐
- 中文释义:卡那霉素B硫酸盐;Aminodeoxykanamycinsulfate kanamycinb,sulfate(1:1)(salt) Bekanamycin sulfate Bekanamycin sulfate salt Kanamycin b sulfate kanamycin b sulfate salt
- 英文别名:bekanamycin sulfate;
KANAMYCIN B SULFATE;
Aminodeoxybekanamycin;
kanamycinb,sulfate(1:1)(salt);
kanamycin B sulphate;
aminodeoxykanamycinsulfate;
BEKANAMYCIN SULFATE SALT;
BEKANAMYCIN SULFATE - cas No.:29701-07-3
- 分子式:
C18H39N5O14S
- 分子量:581.59
- 精确分子量:581.22100
- PSA:371.38000
- InChI:The Key: YGTPKDKJVZOVCO-KELBJJLKSA-N
- 分子结构式:
物化性质
- 密度:
- 1.59g/cm3
- 沸点:
- 807.7ºC at 760mmHg
- 闪点:
- 442.3ºC
- 蒸汽压:
- 3.43E-30mmHg at 25°C
- 存储条件/存储方法:
保持贮藏器密封、储存在阴凉、干燥的地方,确保工作间有良好的通风或排气装置
- 稳定性相关:
如果遵照规格使用和储存则不会分解,未有已知危险反应
- 其它信息:
1. 性状:未确定
2. 密度(g/mL,20℃):未确定
3. 相对蒸汽密度(g/mL,空气=1):未确定
4. 熔点(ºC):未确定
5. 沸点(ºC,常压):未确定
6. 沸点(ºC, KPa):未确定
7. 折射率:未确定
8. 闪点(ºC):未确定
9. 比旋光度(º):未确定
10. 自燃点或引燃温度(ºC):未确定
11. 蒸气压(Pa,20ºC):未确定
12. 饱和蒸气压(KPa,25ºC):未确定
13. 燃烧热(KJ/mol):未确定
14. 临界温度(ºC):未确定
15. 临界压力(KPa):未确定
16. 油水(辛醇/水)分配系数的对数值:未确定
17. 爆炸上限(%,V/V):未确定
18. 爆炸下限(%,V/V):未确定
19. 溶解性:水:50mg/Ml,澄清,无色
安全信息
- 密度:
- 1.59g/cm3
- 沸点:
- 807.7ºC at 760mmHg
- 闪点:
- 442.3ºC
- 蒸汽压:
- 3.43E-30mmHg at 25°C
- 存储条件/存储方法:
保持贮藏器密封、储存在阴凉、干燥的地方,确保工作间有良好的通风或排气装置
- 稳定性相关:
如果遵照规格使用和储存则不会分解,未有已知危险反应
- 其它信息:
1. 性状:未确定
2. 密度(g/mL,20℃):未确定
3. 相对蒸汽密度(g/mL,空气=1):未确定
4. 熔点(ºC):未确定
5. 沸点(ºC,常压):未确定
6. 沸点(ºC, KPa):未确定
7. 折射率:未确定
8. 闪点(ºC):未确定
9. 比旋光度(º):未确定
10. 自燃点或引燃温度(ºC):未确定
11. 蒸气压(Pa,20ºC):未确定
12. 饱和蒸气压(KPa,25ºC):未确定
13. 燃烧热(KJ/mol):未确定
14. 临界温度(ºC):未确定
15. 临界压力(KPa):未确定
16. 油水(辛醇/水)分配系数的对数值:未确定
17. 爆炸上限(%,V/V):未确定
18. 爆炸下限(%,V/V):未确定
19. 溶解性:水:50mg/Ml,澄清,无色
毒理性
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- WK1976500
- CAS REGISTRY NUMBER :
- 29701-07-3
- LAST UPDATED :
- 199103
- DATA ITEMS CITED :
- 11
- MOLECULAR FORMULA :
- C18-H37-N5-O10.H2-O4-S
- MOLECULAR WEIGHT :
- 581.68
- WISWESSER LINE NOTATION :
- T6OTJ B1Q CQ DZ EZ FO- BL6TJ AZ CQ EZ DO- BT6OTJ CQ DZ EQ F1Q &..H2.S-O4
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- >10 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,742,1982
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 1400 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,742,1982
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 1900 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,742,1982
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 141 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,742,1982
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intramuscular
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 1420 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,742,1982
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- >10 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,742,1982
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 760 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,742,1982
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 740 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,742,1982
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 112 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,742,1982
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intramuscular
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 628 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,742,1982
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intracerebral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 5950 ug/kg
- TOXIC EFFECTS :
- Behavioral - somnolence (general depressed activity) Cardiac - other changes Lungs, Thorax, or Respiration - respiratory depression
- REFERENCE :
- NKRZAZ Chemotherapy (Tokyo). (Nippon Kagaku Ryoho Gakkai, 2-20-8 Kamiosaki, Shinagawa-Ku, Tokyo 141, Japan) V.1- 1953- Volume(issue)/page/year: 17,1664,1969
- 毒理学数据:
1、 急性毒性:大鼠经口LD50:>10mg/kg
大鼠腹腔LD50:1400mg/kg
大鼠皮下LD50:1900mg/kg
大鼠静脉注射LD50:141mg/kg
大鼠肌肉LD50:1420mg/kg
小鼠经口LD50:>10mg/kg
小鼠腹腔LD50:760mg/kg
小鼠皮下LD50:740mg/kg
小鼠静脉注射LD50:112mg/kg
小鼠肌肉LD50:628mg/kg
小鼠大脑LD50:5950μg/kg
- 生态数据:
若无政府许可,勿将材料排入周围环境。
分子结构与计算化学数据
计算化学数据
1、 疏水参数计算参考值(XlogP):
2、 氢键供体数量:13
3、 氢键受体数量:19
4、 可旋转化学键数量:6
5、 互变异构体数量:
6、 拓扑分子极性表面积(TPSA):363
7、 重原子数量:38
8、 表面电荷:0
9、 复杂度:721
10、同位素原子数量:0
11、确定原子立构中心数量:15
12、不确定原子立构中心数量:0
13、确定化学键立构中心数量:0
14、不确定化学键立构中心数量:0
15、共价键单元数量:2