None

AlkaPlorer ID: AK420556

Synonym: None

IUPAC Name: [7-[(3,5-dimethyl-2-oxo-3H-furan-4-carbonyl)peroxymethyl]-4-oxido-2,3,5,8-tetrahydro-1H-pyrrolizin-4-ium-1-yl] 2-methylbutanoate

Structure

SMILES: CCC(C)C(=O)OC1CC[N+]2([O-])CC=C(COOC(=O)C3=C(C)OC(=O)C3C)C12

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InChI: InChI=1S/C20H27NO8/c1-5-11(2)18(22)28-15-7-9-21(25)8-6-14(17(15)21)10-26-29-20(24)16-12(3)19(23)27-13(16)4/h6,11-12,15,17H,5,7-10H2,1-4H3

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InChIKey: JFRJYXOOUABEPQ-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 409.4350000000002

TPSA: 111.19000000000004

MolLogP: 1.9129

Number of H-Donors: 0

Number of H-Acceptors: 8

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information