2H-1,24:12,15-Dietheno-6,10-metheno-16H-pyrido[2',3':17,18][1,10]dioxacycloeicosino[2,3,4-ij]isoquinolin-9-ol,3,4,4a,5,16a,17,18,19-octahydro-21,22,26-trimethoxy-4,17-dimethyl-, (4aR,16aS)-

Modify Date: 2025-08-25 07:52:28

2H-1,24:12,15-Dietheno-6,10-metheno-16H-pyrido[2',3':17,18][1,10]dioxacycloeicosino[2,3,4-ij]isoquinolin-9-ol,3,4,4a,5,16a,17,18,19-octahydro-21,22,26-trimethoxy-4,17-dimethyl-, (4aR,16aS)- structure	Common Name	2H-1,24:12,15-Dietheno-6,10-metheno-16H-pyrido[2',3':17,18][1,10]dioxacycloeicosino[2,3,4-ij]isoquinolin-9-ol,3,4,4a,5,16a,17,18,19-octahydro-21,22,26-trimethoxy-4,17-dimethyl-, (4aR,16aS)-
	CAS Number	548-40-3	Molecular Weight	608.72300
	Density	1.204g/cm3	Boiling Point	707ºC at 760mmHg
	Molecular Formula	C₃₇H₄₀N₂O₆	Melting Point	N/A
	MSDS	N/A	Flash Point	381.4ºC

Name	oxyacanthine
Synonym	More Synonyms

Density	1.204g/cm3
Boiling Point	707ºC at 760mmHg
Molecular Formula	C₃₇H₄₀N₂O₆
Molecular Weight	608.72300
Flash Point	381.4ºC
Exact Mass	608.28900
PSA	72.86000
LogP	6.73520
Index of Refraction	1.601
InChIKey	HGNHIFJNOKGSKI-WDYNHAJCSA-N
SMILES	COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1C(Cc1ccc(cc1)Oc1cc(ccc1O)CC3N(C)CC2)N(C)CC4

CHEMICAL IDENTIFICATION

RTECS NUMBER :: RR6475000

CHEMICAL NAME :: Oxyacanthan-12'-ol, 6,6',7-trimethoxy-2,2'-dimethyl-

CAS REGISTRY NUMBER :: 548-40-3

LAST UPDATED :: 199612

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C37-H40-N2-O6

MOLECULAR WEIGHT :: 608.79

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 250 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: NCNSA6 National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. (Washington, DC) Volume(issue)/page/year: 5,17,1953

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 50 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: CPBTAL Chemical and Pharmaceutical Bulletin. (Japan Pub. Trading Co., USA, 1255 Howard St., San Francisco, CA 94103) V.6- 1958- Volume(issue)/page/year: 24,2413,1976

Precursor 0
DownStream 2
CAS#:99-96-7 4-Hydroxybenzoi... CAS#:1263-80-5 2H-1,24:12,15-D...

Oxyacanthine

Oxyacanthin

vinetine

6,7,6'-trimethoxy-2,2'-dimethyl-oxyacanthan-12'-ol

6,6',7-Trimethoxy-2,2'-dimethyloxyacanthan-12'-ol

Oxyacanthan-12'-ol, 6,6',7'-trimethoxy-2,2'-dimethyl-

Oxycanthine

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