Ergosinine

Suppliers

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)

Related Compounds

  • ergosinine
  • Ergosinine
  • Ergosinine methanesulfonate
  • 2-(2-chlorophenyl)-N-(3-(isoxazol-4-yl)propyl)acetamide
  • 1-(tert-Butoxycarbonyl)-3-neopentyl-2-pyrrolidinecarboxylic acid
  • 1-(1-Benzylpyrazol-4-yl)-5-methoxy-3-(2-phenylpyrazol-3-yl)pyridazin-4-one
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(2-(3-(thiophen-2-yl)-1H-pyrazol-1-yl)ethyl)-2,3-dihydrobenzofuran-5-sulfonamide
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide