D-erythro-a-D-galacto-Octopyranoside,2-[(2-hydroxybenzoyl)oxy]ethyl6,8-dideoxy-7-O-methyl-6-[[[(2S)-1-methyl-2-pyrrolidinyl]carbonyl]amino]-1-thio-

Modify Date: 2024-02-05 11:19:17

D-erythro-a-D-galacto-Octopyranoside,2-[(2-hydroxybenzoyl)oxy]ethyl6,8-dideoxy-7-O-methyl-6-[[[(2S)-1-methyl-2-pyrrolidinyl]carbonyl]amino]-1-thio- Structure
D-erythro-a-D-galacto-Octopyranoside,2-[(2-hydroxybenzoyl)oxy]ethyl6,8-dideoxy-7-O-methyl-6-[[[(2S)-1-methyl-2-pyrrolidinyl]carbonyl]amino]-1-thio- structure
Common Name D-erythro-a-D-galacto-Octopyranoside,2-[(2-hydroxybenzoyl)oxy]ethyl6,8-dideoxy-7-O-methyl-6-[[[(2S)-1-methyl-2-pyrrolidinyl]carbonyl]amino]-1-thio-
CAS Number 2520-21-0 Molecular Weight 528.61600
Density 1.39g/cm3 Boiling Point 748.7ºC at 760mmHg
Molecular Formula C24H36N2O9S Melting Point N/A
MSDS N/A Flash Point 406.6ºC

 Names

Name D-erythro-a-D-galacto-Octopyranoside,2-[(2-hydroxybenzoyl)oxy]ethyl6,8-dideoxy-7-O-methyl-6-[[[(2S)-1-methyl-2-pyrrolidinyl]carbonyl]amino]-1-thio
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.39g/cm3
Boiling Point 748.7ºC at 760mmHg
Molecular Formula C24H36N2O9S
Molecular Weight 528.61600
Flash Point 406.6ºC
Exact Mass 528.21400
PSA 183.32000
LogP 0.03250

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RH6125000
CHEMICAL NAME :
D-erythro-D-galacto-Octopyranoside, 2-hydroxyethyl-6,8-dideoxy-7-O-methyl-6-(1-methyl-L- 2-pyrrolidinecarboxamido)-1-thio-, monosalicylate (ester), alpha-
CAS REGISTRY NUMBER :
2520-21-0
BEILSTEIN REFERENCE NO. :
0068470
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C24-H36-N2-O9-S
MOLECULAR WEIGHT :
528.68
WISWESSER LINE NOTATION :
T6OTJ BS2OVR BQ& CQ DQ EQ FYY1&O1&MV- BT5NTJ A1

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 :
300 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CNCRA6 Cancer Chemotherapy Reports. (Bethesda, MD) V.1-52, 1959-68. For publisher information, see CTRRDO. Volume(issue)/page/year: 30,9,1963

 Synonyms

1-Methyl-L-prolin-{(1R,2R)-2-methoxy-1-[(2R)-3c,4c,5t-trihydroxy-6t-(2-salicyloyloxy-aethylmercapto)-tetrahydro-pyran-2r-yl]-propylamid}
celesticetin
1-methyl-L-proline-{(1R,2R)-2-methoxy-1-[(2R)-3c,4c,5t-trihydroxy-6t-(2-salicyloyloxy-ethylsulfanyl)-tetrahydro-pyran-2r-yl]-propylamide}
U-5524