Azirino[2',3'_3,4]pyrrolo[1,2-.α.]indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-hydroxy-8-(hydroxymethyl)-8a-methoxy-5-methyl-, 8-carbamate

Modify Date: 2024-01-15 17:25:10

Azirino[2',3'_3,4]pyrrolo[1,2-.α.]indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-hydroxy-8-(hydroxymethyl)-8a-methoxy-5-methyl-, 8-carbamate Structure
Azirino[2',3'_3,4]pyrrolo[1,2-.α.]indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-hydroxy-8-(hydroxymethyl)-8a-methoxy-5-methyl-, 8-carbamate structure
Common Name Azirino[2',3'_3,4]pyrrolo[1,2-.α.]indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-hydroxy-8-(hydroxymethyl)-8a-methoxy-5-methyl-, 8-carbamate
CAS Number 7041-61-4 Molecular Weight 335.31200
Density 1.61g/cm3 Boiling Point 512.1ºC at 760 mmHg
Molecular Formula C15H17N3O6 Melting Point N/A
MSDS N/A Flash Point 263.5ºC

 Names

Name Azirino[2',3'_3,4]pyrrolo[1,2-.α.]indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-hydroxy-8-(hydroxymethyl)-8a-methoxy-5-methyl-, 8-carbamate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.61g/cm3
Boiling Point 512.1ºC at 760 mmHg
Molecular Formula C15H17N3O6
Molecular Weight 335.31200
Flash Point 263.5ºC
Exact Mass 335.11200
PSA 141.10000
Index of Refraction 1.683

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CN0880000
CAS REGISTRY NUMBER :
7041-61-4
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C15-H17-N3-O6
MOLECULAR WEIGHT :
335.35

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JAJAAA Journal of Antibiotics, Series A. (Tokyo, Japan) V.6-20, 1953-67. For publisher information, see JANTAJ. Volume(issue)/page/year: 20,72,1967

 Synthetic Route

~84%

Azirino[2',3'_3,4]pyrrolo[1,2-.α.]indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-hydroxy-8-(hydroxymethyl)-8a-methoxy-5-methyl-, 8-carbamate Structure

Azirino[2',3'_3...

CAS#:7041-61-4

Literature: Grueschow, Sabine; Chang, Leng-Chee; Mao, Yingqing; Sherman, David H. Journal of the American Chemical Society, 2007 , vol. 129, # 20 p. 6470 - 6476

~%

Azirino[2',3'_3,4]pyrrolo[1,2-.α.]indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-hydroxy-8-(hydroxymethyl)-8a-methoxy-5-methyl-, 8-carbamate Structure

Azirino[2',3'_3...

CAS#:7041-61-4

Literature: Beijnen; Van der Houwen; Rosing; Underberg Chemical and Pharmaceutical Bulletin, 1986 , vol. 34, # 7 p. 2900 - 2913

 Synonyms

7-demethylmitomycin A
N-[2-(7-hydroxy-naphthalen-1-yl)ethyl]acetamide
N-[2-(7-hydroxy-naphth-1-yl)ethyl]acetamide
7-Demethyl-Agomelatine
7-hydroxymitosane
7-hydroxy-9a-methoxymitosane
N-[2-(7-Hydroxy-1-naphthyl)ethyl]-acetamide
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