Pulcherrimine

AlkaPlorer ID: AK311638

Synonym: 4-[(2-Carboxy-2-hydroxyethyl)thio]-2-piperidinecarboxylic acid

IUPAC Name: 4-(2-carboxy-2-hydroxyethyl)sulfanylpiperidine-2-carboxylic acid

Structure

SMILES: O=C(O)C(O)CSC1CCNC(C(=O)O)C1

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InChI: InChI=1S/C9H15NO5S/c11-7(9(14)15)4-16-5-1-2-10-6(3-5)8(12)13/h5-7,10-11H,1-4H2,(H,12,13)(H,14,15)

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InChIKey: MMEPFCTYQGYQJY-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 249.288

TPSA: 106.86

MolLogP: -0.6296999999999995

Number of H-Donors: 4

Number of H-Acceptors: 5

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information