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Basic information
- CAS
465-22-5- Standard SMILES
C[C@]12CC[C@H](O)C=C1CC[C@@H]1[C@@H]2CC[C@]2(C)C(c3ccc(=O)oc3)CC[C@]12O- Molecular formula
- C24H32O4
- Average molar mass
- 384.51 g/mol
Names & identifiers
- Preferred name
- scillarenin
- English name
- scillarenin
- Molecular formula
- C24H32O4
- Molecular weight
- 384.51
Names & synonyms
NSC 234669scillareninCardiogeninScillarenineScillarenin A3β-Scillarenin3β,14-Dihydroxybufa-4,20,22-trienolide(3β)-3,14-Dihydroxybufa-4,20,22-trienolide3β,14-Dihydroxy-14β-bufa-4,20,22-trienolideBufa-4,20,22-trienolide, 3,14-dihydroxy-, (3β)-
Database identifiers
- CAS
465-22-5- PubChem CID
- 314799
- ChEMBL
CHEMBL1982527
Properties
Physicochemical properties
- Melting point
- 232 · 232-238°
- alpha
- 20 · D20 -16.8° (c = 0.357 in methanol); D20 +17.9° (c = 0.39 in chloroform)
- Boiling point
- 572.6 · 572.6±50.0 °C(Predicted)
- Density
- 1.24 · 1.24±0.1 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C Freezer
- solubility
- Pyridine (Slightly)
- form
- Solid
- pka
- 14.34 · 14.34±0.70(Predicted)
- color
- White to Off-White
- FDA UNII
- 96 RSL6E · XIA96RSL6E
- Toxicity
- 0.1567 mg/kg · Mean LD i.v. in cats: 0.1567 mg/kg (Chen, Henderson)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Toxicity
- Mean LD i.v. in cats: 0.1567 mg/kg (Chen, Henderson)
Chemistry & industry
Applications
UsesScillarenin is a bufadienolide derivative that acts as a cardiotonic agent. A metabolite of Meproscillarin.
Suppliers5 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
上海梅凯科技有限公司021-68689288 15300790979 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
Additional notes
DefinitionChEBI: Scillarenin is a 3beta-hydroxy steroid and a 14beta-hydroxy steroid. It is functionally related to a bufanolide.
Related reactions
0 records
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Compound notes
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