Molecule

Pantocin A

AlkaPlorer ID: AK046678

Synonym: None

IUPAC Name: (2S)-4-amino-2-[[(6S)-6-amino-7-oxo-1,5,6,7a-tetrahydroindene-1-carbonyl]amino]-4-oxobutanoic acid

Structure

SMILES: N=C(O)C[C@H](N=C(O)C1C=CC2=CC[C@H](N)C(=O)C21)C(=O)O

InChI: InChI=1S/C14H17N3O5/c15-8-4-2-6-1-3-7(11(6)12(8)19)13(20)17-9(14(21)22)5-10(16)18/h1-3,7-9,11H,4-5,15H2,(H2,16,18)(H,17,20)(H,21,22)/t7?,8-,9-,11?/m0/s1

InChIKey: SOPAHPGXYDUTGN-QMFGVRBNSA-N

Reference

Structural and Functional Analysis of Pantocin A: An Antibiotic from <i>Pantoea agglomerans</i> Discovered by Heterologous Expression of Cloned Genes

PubChem CID: 139587328

LOTUS: LTS0017289

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NPAtlas: NPA015179

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Pantoea agglomerans	Pantoea	Erwiniaceae	Enterobacterales	Gammaproteobacteria	Pseudomonadota	None	Bacteria

Properties Information

Molecule Weight: 307.30600000000004

TPSA？: 157.05999999999997

MolLogP？: 0.3501700000000001

Number of H-Donors: 5

Number of H-Acceptors: 5

RingCount: 2

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi