Ergosinine
Names
[ CAS No. ]:
561-94-4
[ Name ]:
Ergosinine
[Synonym ]:
12'-hydroxy-5'-isobutyl-2'-methyl-ergotamane-18,3',6'-trione
Ergotaman-3',6',18-trione, 12'-hydroxy-2'-methyl-5'-(2-methylpropyl)-, (5'α)-
Ergotaman-3',6',18-trione, 12'-hydroxy-2'-methyl-5'- (2-methylpropyl)-, (5'α)-
Ergoclavine
(5'α)-12'-hydroxy-2'-methyl-5'-(2-methylpropyl)-3',6',18-trioxoergotaman
Ergotaman, 12'-hydroxy-2'-methyl-5'-(2-methylpropyl)-3',6',18-trioxo-, (5'α)-
α-Ergosine
(5'α,10α)-9,10-Dihydro-12'-hydroxy-2'-methyl-5'-(2-methylpropyl)ergotaman-3',6',18-trione
Ergosinine
Ergotaman-3',6',18-trione,12'-hydroxy-2'-methyl-5'-(2-methylpropyl)-, (5'a)-
Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(2-methylpropyl)-, (5'α,10α)-
12'-Hydroxy-2'-methyl-5'a-(2-methylpropyl)ergotaman-3',6',18-trione
(5'α)-12'-Hydroxy-5'-isobutyl-2'-methyl-3',6',18-trioxoergotaman
Chemical & Physical Properties
[ Density]:
1.4±0.1 g/cm3
[ Boiling Point ]:
861.4±65.0 °C at 760 mmHg
[ Molecular Formula ]:
C30H37N5O5
[ Molecular Weight ]:
547.645
[ Flash Point ]:
474.7±34.3 °C
[ Exact Mass ]:
547.279480
[ PSA ]:
118.21000
[ LogP ]:
3.20
[ Vapour Pressure ]:
0.0±0.3 mmHg at 25°C
[ Index of Refraction ]:
1.700
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- KE7200000
- CHEMICAL NAME :
- Ergosine
- CAS REGISTRY NUMBER :
- 561-94-4
- BEILSTEIN REFERENCE NO. :
- 0102152
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C30-H37-N5-O5
- MOLECULAR WEIGHT :
- 547.72
- WISWESSER LINE NOTATION :
- T C6656 1A P GN LM IHT&&&J G1 EVM- DT B565 CO EVN HVNTJ BQ D1 G1Y1&1
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 100 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- EXPEAM Experientia. (Birkhaeuser Verlag, POB 133, CH-4010 Basel, Switzerland) V.1- 1945- Volume(issue)/page/year: 33,1552,1977
Safety Information
[ RIDADR ]:
UN 1544
[ Packaging Group ]:
III
[ Hazard Class ]:
6.1(b)