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Resibufogenin Acetate
[CAS# 4029-64-5]

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CAS#: 4029-64-5
Product: Resibufogenin Acetate
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Identification
Name Resibufogenin Acetate
Synonyms Acetylresibufogenin; Bufa-20,22-Dienolide, 3-(Acetyloxy)-14,15-Epoxy-, (3-Beta,5-Beta,15-Beta)-; Nsc 135688
Molecular Structure CAS#: 4029-64-5, Resibufogenin Acetate
Molecular Formula C26H34O5
Molecular Weight 426.55
CAS Registry Number 4029-64-5
SMILES [C@]124[C@@]([C@H](C[C@H]1O2)C3=COC(C=C3)=O)(CCC5C4CC[C@H]6[C@@]5(CC[C@@H](C6)OC(C)=O)C)C
InChI 1S/C26H34O5/c1-15(27)30-18-8-10-24(2)17(12-18)5-6-20-19(24)9-11-25(3)21(13-22-26(20,25)31-22)16-4-7-23(28)29-14-16/h4,7,14,17-22H,5-6,8-13H2,1-3H3/t17-,18+,19?,20?,21-,22-,24+,25-,26-/m1/s1
InChIKey PYQLJWZNYPKLBI-BUOBTXRUSA-N
Properties
Density 1.236g/cm3 (Cal.)
Boiling point 558.239°C at 760 mmHg (Cal.)
Flash point 240.041°C (Cal.)
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