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Chemical structure of 3-O-Acetylbufotalin

GC35117

3-O-Acetylbufotalin

Also known as [16-acetyloxy-14-hydroxy-10,13-dimethyl-17-(6-oxopyran-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate

3-O-Acetylbufotalin is a derivate of bufadienolide, with anti-cancer activity

ChemicalCAS4029-69-0MW486.6FormulaC28H38O7
CAS number
4029-69-0
Molecular weight
486.6
Formula
C28H38O7
Solubility
Soluble in DMSO
InChIKey
NHHVQEFHQTULER-UHFFFAOYSA-N
Catalogue number
GC35117
Brand
GLPBIO
Computed properties PubChem CID 282304 · XLogP 3.1 · TPSA 99.1 Ų · H-bond donors 1
XLogP
3.1
TPSA
99.1 Ų
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
35

SMILES CC(=O)OC1CCC2(C(C1)CCC3C2CCC4(C3(CC(C4C5=COC(=O)C=C5)OC(=O)C)O)C)C

Computed descriptors from PubChem (CID 282304), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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