465-16-7
Product Name:
OLEANDRIN
Formula:
C32H48O9
Synonyms:
Foliandrin;Neriol;Neriolin;Neriostene;Folinerin
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Solid; [Merck Index] Colorless odorless solid; [IARC] |
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Color/Form | Crystals from ethanol |
Melting Point | 250 °C |
Solubility | Practically insoluble in water |
LogP | log Kow = 2.53 |
Stability/Shelf Life | Stable under recommended storage conditions. |
Optical Rotation | Specific optical rotation: -48.0 deg at 25 °C/D (c= 1.3 in methanol) |
Decomposition | When heated to decomposition it emits acrid smoke and irritating fumes. |
Other Experimental Properties | Leaflets from alcohol. MP: 138-240 °C. Specific optical rotation: -24.9 deg at 18 °C/D /Oleandrin desacetyloleandrin/ |
Chemical Classes | Biological Agents -> Plant Toxins |
SAFETY INFORMATION
Signal word | Danger |
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Pictogram(s) |
Skull and Crossbones Acute Toxicity GHS06 Health Hazard GHS08 |
GHS Hazard Statements |
H373:Specific target organ toxicity, repeated exposure |
Precautionary Statement Codes |
P260:Do not breathe dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P284:Wear respiratory protection. P403+P233:Store in a well-ventilated place. Keep container tightly closed. |
COMPUTED DESCRIPTORS
Molecular Weight | 576.7 g/mol |
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XLogP3 | 2.4 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 9 |
Rotatable Bond Count | 6 |
Exact Mass | 576.32983310 g/mol |
Monoisotopic Mass | 576.32983310 g/mol |
Topological Polar Surface Area | 121 Ų |
Heavy Atom Count | 41 |
Formal Charge | 0 |
Complexity | 1080 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 13 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Oleandrin is a steroid saponin that consists of oleandrigenin having a 2,6-dideoxy-3-O-methyl-alpha-L-arabino-hexopyranosyl residue attached to the oxygen function at position 3. It is a cardenolide glycoside, a 14beta-hydroxy steroid, a steroid ester and a steroid saponin. It is functionally related to an oleandrigenin.