Acetylresibufogenin

[(2S,4R,6R,7R,11S,14S,16R)-7,11-dimethyl-6-(6-oxopyran-3-yl)-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadecan-14-yl] acetate

CAS: 4029-64-5

Molecular Formula	`C26H34O5`
Molecular Weight	426.5 g/mol
LogP	4.3
Topological Polar Surface Area	65.1 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	3
Exact Mass	426.24063
Heavy Atoms	31
Complexity	890.0

Chemical Identifiers

CAS Number	4029-64-5
SMILES	`CC(=O)OC1CCC2(C(C1)CCC3C2CCC4(C35C(O5)CC4C6=COC(=O)C=C6)C)C`
InChIKey	`PYQLJWZNYPKLBI-BUOBTXRUSA-N`

📖 Product Overview

Acetylresibufogenin (CAS: 4029-64-5) is a chemical compound with molecular formula C26H34O5 and molecular weight 426.5 g/mol. Its IUPAC systematic name is [(2S,4R,6R,7R,11S,14S,16R)-7,11-dimethyl-6-(6-oxopyran-3-yl)-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadecan-14-yl] acetate. LogP 4.3 Topological Polar Surface Area 65.1 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 5 Rotatable Bonds 3 Exact Mass 426.24063 Heavy Atoms 31 Complexity 890.0 InChI Key: PYQLJWZNYPKLBI-BUOBTXRUSA-N. SMILES: CC(=O)OC1CCC2(C(C1)CCC3C2CCC4(C35C(O5)CC4C6=COC(=O)C=C6)C)C.

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