76155-18-5

76155-18-5 structure
76155-18-5 structure

Name 1,2,3-trimethoxy-10-methylsulfanyl-7-[(3,4,5-trihydroxyoxan-2-yl)amino]-6,7-dihydro-5H-benzo[a]heptalen-9-one
Density 1.4g/cm3
Boiling Point 797.8ºC at 760 mmHg
Molecular Formula C25H31NO8S
Molecular Weight 505.58100
Flash Point 436.3ºC
Exact Mass 505.17700
PSA 152.01000
LogP 1.86830
Index of Refraction 1.649

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DF9484000
CHEMICAL NAME :
Benzo(a)heptalen-9(5H)-one, 7-(alpha-L-arabinosylamino)-6,7-dihydro-1,2,3-trimeth oxy-10- (methylthio)-, (S)-
CAS REGISTRY NUMBER :
76155-18-5
LAST UPDATED :
198408
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C25-H31-N-O8-S
MOLECULAR WEIGHT :
505.63
WISWESSER LINE NOTATION :
L B677 MV&T&J CO1 DO1 EO1 NS1 JM- BT6OTJ CQ DQ EQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
53 mg/kg
TOXIC EFFECTS :
Tumorigenic - active as anti-cancer agent
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 24,636,1981