Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-((tetrahydro-2H-pyran-2-yl)oxy)-, methyl ester, (3beta,16beta,17alpha,18beta,20alpha)- (9CI)
Names
[ CAS No. ]:
751-73-5
[ Name ]:
Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-((tetrahydro-2H-pyran-2-yl)oxy)-, methyl ester, (3beta,16beta,17alpha,18beta,20alpha)- (9CI)
[Synonym ]:
11,17-dimethoxy-18-tetrahydropyran-2-yloxy-yohimbane-16-carboxylic acid methyl ester
Su-7064
Chemical & Physical Properties
[ Density]:
1.27g/cm3
[ Boiling Point ]:
638.9ºC at 760 mmHg
[ Molecular Formula ]:
C28H38N2O6
[ Molecular Weight ]:
498.61100
[ Flash Point ]:
340.2ºC
[ Exact Mass ]:
498.27300
[ PSA ]:
82.25000
[ LogP ]:
3.76940
[ Index of Refraction ]:
1.608
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- ZF9800000
- CHEMICAL NAME :
- 3-beta,20-alpha-Yohimban-16-beta-carboxylic acid, 11-alpha,17-alpha-dimethoxy-18-beta- (tetrahydro-2-pyranyloxy)-, methyl ester
- CAS REGISTRY NUMBER :
- 751-73-5
- LAST UPDATED :
- 199012
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C28-H38-N2-O6
- MOLECULAR WEIGHT :
- 498.68
- WISWESSER LINE NOTATION :
- T F6 D5 C666 EM ON&&TTTJ HO1 TO1 UVO1 SO- BT6OTJ
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 :
- 173 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- 27ZQAG "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972 Volume(issue)/page/year: -,112,1972
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 7 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- 27ZQAG "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972 Volume(issue)/page/year: -,112,1972