7041-61-4

7041-61-4 structure

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
Chemical 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 Formula: C₁₅H₁₇N₃O₆
Molecular Weight: 335.31200
Create Date: 2016-02-03 07:01:18
Modify Date: 2025-08-26 07:54:25

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
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

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

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

50-07-7

~84%

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

4055-39-4

7041-61-4

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

Precursor 2
50-07-7 4055-39-4
DownStream 3
105139-98-8 4055-39-4 56981-68-1

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