3-Amino-5,6,7,7a-tetrahydro-7a-hydroxy-2-methyl-1H-pyrrolizin-1-one; (ξ)-form, 3-N-(3-Methylbutanoyl) 

AlkaPlorer ID: AK287524

Synonym: Legonmycin A

IUPAC Name: N-(8-hydroxy-2-methyl-1-oxo-6,7-dihydro-5H-pyrrolizin-3-yl)-3-methylbutanamide

Structure

SMILES: CC1=C(N=C(O)CC(C)C)N2CCCC2(O)C1=O

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InChI: InChI=1S/C13H20N2O3/c1-8(2)7-10(16)14-12-9(3)11(17)13(18)5-4-6-15(12)13/h8,18H,4-7H2,1-3H3,(H,14,16)

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InChIKey: PLSCDSCQUZWYJL-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 252.314

TPSA: 73.13

MolLogP: 1.5876

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information