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Chemical structure of α-Angelica lactone

GC61980

α-Angelica lactone

Also known as 2-methyl-2H-furan-5-one

α-Angelica lactone is a naturally occurring anticarcinogen and an vinylogous nucleophile· α-Angelica lactone can give the chiral δ-amino γ,γ-disubstituted butenolide carbonyl derivatives and exhibitselectrophilic trapping at the γ-carbon· α-Angelica lactone exerts strong chemoprotective effects by selective enhancement of glutathione-S-thansferase (GST) and UDP-glucononosyltransferase (UGT) detoxification enzymes

ChemicalCAS591-12-8MW98.1FormulaC5H6O2
CAS number
591-12-8
Molecular weight
98.1
Formula
C5H6O2
Solubility
DMSO : 100 mg/mL (1019·37 mM)
InChIKey
BGLUXFNVVSVEET-UHFFFAOYSA-N
Catalogue number
GC61980
Brand
GLPBIO
Computed properties PubChem CID 11558 · XLogP 0.6 · TPSA 26.3 Ų · H-bond donors 0
XLogP
0.6
TPSA
26.3 Ų
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
7

SMILES CC1C=CC(=O)O1

Computed descriptors from PubChem (CID 11558), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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