4,5-Dihydroxy-3-methylene-2(1H)-pyrrolidinone; (4R*,5S*)-form, 5-Butyl ether 

AlkaPlorer ID: AK296298

Synonym: 5-Butoxy-4-hydroxy-3-methylene-2(1H)-pyrrolidinone 

IUPAC Name: 5-butoxy-4-hydroxy-3-methylidenepyrrolidin-2-one

Structure

SMILES: C=C1C(=O)NC(OCCCC)C1O

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InChI: InChI=1S/C9H15NO3/c1-3-4-5-13-9-7(11)6(2)8(12)10-9/h7,9,11H,2-5H2,1H3,(H,10,12)

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InChIKey: YEGNHFRGBNUOLZ-UHFFFAOYSA-N

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Reference

PubChem CID: 91448793

CAS: 1111692-43-3

Source

Properties Information

Molecule Weight: 185.223

TPSA: 58.56

MolLogP: 0.1760999999999997

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information