Dibenzo[f,h]pyrrolo[1,2-b]isoquinoline,9,11,12,13,13a,14-hexahydro-2,3,5,6-tetramethoxy-, (13aR)-

Modify Date: 2024-01-15 21:16:18

Dibenzo[f,h]pyrrolo[1,2-b]isoquinoline,9,11,12,13,13a,14-hexahydro-2,3,5,6-tetramethoxy-, (13aR)- Structure
Dibenzo[f,h]pyrrolo[1,2-b]isoquinoline,9,11,12,13,13a,14-hexahydro-2,3,5,6-tetramethoxy-, (13aR)- structure
Common Name Dibenzo[f,h]pyrrolo[1,2-b]isoquinoline,9,11,12,13,13a,14-hexahydro-2,3,5,6-tetramethoxy-, (13aR)-
CAS Number 6879-02-3 Molecular Weight 393.47500
Density 1.26g/cm3 Boiling Point 559.9ºC at 760 mmHg
Molecular Formula C24H27NO4 Melting Point N/A
MSDS N/A Flash Point 160.5ºC

 Names

Name Tylocrebrine
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.26g/cm3
Boiling Point 559.9ºC at 760 mmHg
Molecular Formula C24H27NO4
Molecular Weight 393.47500
Flash Point 160.5ºC
Exact Mass 393.19400
PSA 40.16000
LogP 4.48580
Vapour Pressure 1.44E-12mmHg at 25°C
Index of Refraction 1.657

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YP0175000
CHEMICAL NAME :
Tylocrebrine
CAS REGISTRY NUMBER :
6879-02-3
LAST UPDATED :
199612
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C24-H27-N-O4
MOLECULAR WEIGHT :
393.52
WISWESSER LINE NOTATION :
T D5 B6 K666 DNJ MO1 NO1 RO1 SO1

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 :
65 mg/kg
TOXIC EFFECTS :
Behavioral - changes in motor activity (specific assay) Gastrointestinal - hypermotility, diarrhea Skin and Appendages - hair
REFERENCE :
NCICP* Progress Report Submitted to the National Cancer Institute by Charles Pfizer & Co. Volume(issue)/page/year: -,77,1964
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
32 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Behavioral - ataxia Gastrointestinal - hypermotility, diarrhea
REFERENCE :
NCICP* Progress Report Submitted to the National Cancer Institute by Charles Pfizer & Co. Volume(issue)/page/year: -,77,1964
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
50 mg/kg
TOXIC EFFECTS :
Behavioral - changes in motor activity (specific assay) Behavioral - ataxia Gastrointestinal - hypermotility, diarrhea
REFERENCE :
NCICP* Progress Report Submitted to the National Cancer Institute by Charles Pfizer & Co. Volume(issue)/page/year: -,77,1964
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
42 mg/kg
TOXIC EFFECTS :
Behavioral - tremor Behavioral - convulsions or effect on seizure threshold Behavioral - ataxia
REFERENCE :
NCICP* Progress Report Submitted to the National Cancer Institute by Charles Pfizer & Co. Volume(issue)/page/year: -,77,1964 ** OTHER MULTIPLE DOSE TOXICITY DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Mammal - dog
DOSE/DURATION :
12 mg/kg/24D-I
TOXIC EFFECTS :
Gastrointestinal - changes in structure or function of esophagus Gastrointestinal - ulceration or bleeding from large intestine Blood - other changes
REFERENCE :
NCICP* Progress Report Submitted to the National Cancer Institute by Charles Pfizer & Co. Volume(issue)/page/year: -,77,1964
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Primate - monkey
DOSE/DURATION :
24 mg/kg/24D-I
TOXIC EFFECTS :
Liver - other changes Blood - pigmented or nucleated red blood cells Blood - changes in erythrocyte (RBC) count
REFERENCE :
NCICP* Progress Report Submitted to the National Cancer Institute by Charles Pfizer & Co. Volume(issue)/page/year: -,77,1964

 Synthetic Route

~63%

Dibenzo[f,h]pyrrolo[1,2-b]isoquinoline,9,11,12,13,13a,14-hexahydro-2,3,5,6-tetramethoxy-, (13aR)- Structure

Dibenzo[f,h]pyr...

CAS#:6879-02-3

Literature: Niphakis, Micah J.; Georg, Gunda I. Organic Letters, 2011 , vol. 13, # 2 p. 196 - 199

~%

Dibenzo[f,h]pyrrolo[1,2-b]isoquinoline,9,11,12,13,13a,14-hexahydro-2,3,5,6-tetramethoxy-, (13aR)- Structure

Dibenzo[f,h]pyr...

CAS#:6879-02-3

Literature: Niphakis, Micah J.; Georg, Gunda I. Organic Letters, 2011 , vol. 13, # 2 p. 196 - 199

~%

Dibenzo[f,h]pyrrolo[1,2-b]isoquinoline,9,11,12,13,13a,14-hexahydro-2,3,5,6-tetramethoxy-, (13aR)- Structure

Dibenzo[f,h]pyr...

CAS#:6879-02-3

Literature: Niphakis, Micah J.; Georg, Gunda I. Organic Letters, 2011 , vol. 13, # 2 p. 196 - 199

~%

Dibenzo[f,h]pyrrolo[1,2-b]isoquinoline,9,11,12,13,13a,14-hexahydro-2,3,5,6-tetramethoxy-, (13aR)- Structure

Dibenzo[f,h]pyr...

CAS#:6879-02-3

Literature: Niphakis, Micah J.; Georg, Gunda I. Organic Letters, 2011 , vol. 13, # 2 p. 196 - 199

 Precursor & DownStream

Precursor  2

DownStream  0

 Synonyms

Tylocerebrine
[13aR,(+)]-9,11,12,13,13a,14-Hexahydro-2,3,5,6-tetramethoxydibenzo[f,h]pyrrolo[1,2-b]isoquinoline
(-)-(R)-tylocrebrine
Tylocrebrin
Dibenzo(F,H)pyrrolo(1,2-B)isoquinoline,9,11,12,13,13A,14-hexahydro-2,3,5,6-tetramethoxy-,(R)-(9ci)
Dibenzo(F,H)pyrrolo(1,2-B)isoquinoline,9,11,12,13,13A,14-hexahydro-2,3,5,6-tetramethoxy
Lylocrebrine
Tylocrebine