Substance

ID:352630

Names and Identifiers
IUPAC Traditional name
digitoxin
Synonyms
5β,20(22)-Cardenolide-3β,14-diol-3-(O-2,6-dideoxy-β-D-ribo-hexopyranosyl-[1→4]-O-2,6-dideoxy-β-D-ribo-hexopyranosyl-[1→4]-2,6-dideoxy-β-D-ribo-hexopyranosyl)oxy洋地黄毒苷Digitoxin
IUPAC name
4-[(1S,2S,5S,7R,10R,11S,14R,15R)-5-{[(2R,4S,5S,6R)-5-{[(2S,4S,5S,6R)-5-{[(2S,4S,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy}-4-hydroxy-6-methyloxan-2-yl]oxy}-4-hydroxy-6-methyloxan-2-yl]oxy}-11-hydroxy-2,15-dimethyltetracyclo[8.7.0.02,7.011,15]heptadecan-14-yl]-2,5-dihydrofuran-2-one
Registration numbers
CAS Number
71-63-6
EC Number
200-760-5
Beilstein Number
76678
MDL Number
MFCD00003686
Properties
Safety Information
European Hazard Symbols
Toxic Toxic (T)
GHS Pictograms
GHS08
Respiratory sensitization, category 1
Germ cell mutagenicity, categories 1A,1B,2
Carcinogenicity, categories 1A,1B,2
Reproductive toxicity, categories 1A,1B,2
Specific Target Organ Toxicity – Single exposure, categories 1,2
Specific Target Organ Toxicity – Repeated exposure, categories 1,2
Aspiration Hazard, category 1
GHS06
Acute toxicity (oral, dermal, inhalation), categories 1,2,3
MSDS Link
Download link
GHS Hazard statements
H301-H331-H373
GHS Signal Word
Danger
RTECS
IH2275000
Safety Statements
45
UN Number
2811
Packing Group
1
RID/ADR
UN 2811 6.1/PG 1
Risk Statements
23/25-33
GHS Precautionary statements
P261-P301+P310-P311
Hazard Class
6.1
German water hazard class
3
Personal Protective Equipment
Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
Physical Property
Optical Rotation
[α]20/D +17±1°, 7 hr, c = 2% in chloroform
Melting Point
240 °C (dec.)(lit.)
Product Information
Empirical Formula (Hill Notation)
C41H64O13
Ignition Residue
≤0.05%
Purity
≥98.0% (HPLC)
Molecule Details
No Data Available
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Molecular Spectra
No Data Available
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References
No Data Available
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