3-Aminodihydro-2(3H)-furanone; (S)-form, N-Butanoyl 

AlkaPlorer ID: AK284996

Synonym: N-(Tetrahydro-2-oxo-3-furanyl)butanamide, N-Butanoylhomoserine lactone, C4-HSL, PAI 2 

IUPAC Name: N-(2-oxooxolan-3-yl)butanamide

Structure

SMILES: CCCC(O)=NC1CCOC1=O

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InChI: InChI=1S/C8H13NO3/c1-2-3-7(10)9-6-4-5-12-8(6)11/h6H,2-5H2,1H3,(H,9,10)

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InChIKey: VFFNZZXXTGXBOG-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 171.19599999999997

TPSA: 58.89000000000001

MolLogP: 1.0585

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT007376 CCCC(=O)NC1CCOC1=O>>CCCC(=O)NC(CCO)C(=O)O enzymemap_52179