α-D-Glucopyranosyl (3β)-3-[(4-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]olean-12-en-28-oate
-
![α-D-Glucopyranosyl (3β)-3-[(4-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]olean-12-en-28-oate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d0c325f44e9d4c6ab58565d9afd2e8cc.png "α-D-Glucopyranosyl (3β)-3-[(4-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]olean-12-en-28-oate")
α-D-Glucopyranosyl (3β)-3-[(4-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]olean-12-en-28-oate
structure -
-
CAS No:
34381-98-1
-
Formula:
C48H78O18
-
Chemical Name:
α-D-Glucopyranosyl (3β)-3-[(4-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]olean-12-en-28-oate
-
Synonyms:
Olean-12-en-28-oic acid,3-[(4-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]-,α-D-glucopyranosyl ester,(3β)-;Calenduloside B;α-D-Glucopyranosyl (3β)-3-[(4-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]olean-12-en-28-oate
-
CAS No:
α-D-Glucopyranosyl (3β)-3-[(4-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]olean-12-en-28-oate Basic Attributes
943.1 g/mol
943.12
Toxicity
| Name | Type of Test | Exposure Route | Species Observed | Dose/Duration | Toxic Effects | Reference |
|---|---|---|---|---|---|---|
| ACUTE TOXICITY DATA | LD - Lethal dose | Oral | Rodent - mouse | >1 gm/kg | Details of toxic effects not reported other than lethal dose value-- | Farmakologiya i Toksikologiya (Moscow). For English translation, see PHTXA6 and RPTOAN. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.2- 1939- Volume(issue)/page/year: 41,556,1978 |
| ACUTE TOXICITY DATA | LDLo - Lowest published lethal dose | Intraperitoneal | Rodent - mouse | 600 mg/kg | Details of toxic effects not reported other than lethal dose value-- | Farmakologiya i Toksikologiya (Moscow). For English translation, see PHTXA6 and RPTOAN. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.2- 1939- Volume(issue)/page/year: 41,556,1978 |
| ACUTE TOXICITY DATA | LD - Lethal dose | Subcutaneous | Rodent - mouse | >1 gm/kg | Details of toxic effects not reported other than lethal dose value-- | Farmakologiya i Toksikologiya (Moscow). For English translation, see PHTXA6 and RPTOAN. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.2- 1939- Volume(issue)/page/year: 41,556,1978 |
Computed Properties
Molecular Weight:943.1
XLogP3:1.9
Hydrogen Bond Donor Count:11
Hydrogen Bond Acceptor Count:18
Rotatable Bond Count:10
Exact Mass:942.51881563
Monoisotopic Mass:942.51881563
Topological Polar Surface Area:295
Heavy Atom Count:66
Complexity:1800
Defined Atom Stereocenter Count:22
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Request for Quotation