Molecule

TAN-1057B

AlkaPlorer ID: AK078099

Synonym: None

IUPAC Name: (3S)-3-amino-N-[(5R)-2-(carbamoylamino)-6-oxo-4,5-dihydro-1H-pyrimidin-5-yl]-6-(diaminomethylideneamino)-N-methylhexanamide

Structure

SMILES: CN(C(=O)C[C@@H](N)CCCNC(=N)N)[C@@H]1CN=C(NC(=N)O)N=C1O

InChI: InChI=1S/C13H25N9O3/c1-22(8-6-19-13(20-10(8)24)21-12(17)25)9(23)5-7(14)3-2-4-18-11(15)16/h7-8H,2-6,14H2,1H3,(H4,15,16,18)(H4,17,19,20,21,24,25)/t7-,8+/m0/s1

InChIKey: ZMWBCGMRXBPXEU-JGVFFNPUSA-N

Reference

TAN-1057 A-D, new antibiotics with potent antibacterial activity against methicillin-resistant Staphylococcus aureus. Taxonomy, fermentation and biological activity.

PubChem CID: 124498

CAS: 128126-45-4

LOTUS: LTS0067044

SuperNatural Ⅲ: SN0474701-02

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NPAtlas: NPA014482

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Flexibacter sp.	Flexibacter	Flexibacteraceae	Cytophagales	Cytophagia	Bacteroidota	None	Bacteria

Properties Information

Molecule Weight: 355.403

TPSA？: 209.29

MolLogP？: -1.7974599999999956

Number of H-Donors: 8

Number of H-Acceptors: 6

RingCount: 1

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi