Molecule

Tyropeptin B

AlkaPlorer ID: AK041885

Synonym: None

IUPAC Name: (2S)-2-[[(2S)-2-(butanoylamino)-3-(4-hydroxyphenyl)propanoyl]amino]-N-[1-(4-hydroxyphenyl)-3-oxopropan-2-yl]-4-methylpentanamide

Structure

SMILES: CCCC(O)=N[C@@H](CC1=CC=C(O)C=C1)C(O)=N[C@@H](CC(C)C)C(O)=NC(C=O)CC1=CC=C(O)C=C1

InChI: InChI=1S/C28H37N3O6/c1-4-5-26(35)30-25(16-20-8-12-23(34)13-9-20)28(37)31-24(14-18(2)3)27(36)29-21(17-32)15-19-6-10-22(33)11-7-19/h6-13,17-18,21,24-25,33-34H,4-5,14-16H2,1-3H3,(H,29,36)(H,30,35)(H,31,37)/t21?,24-,25-/m0/s1

InChIKey: SYAOZPXWOOYNES-MHKYCTGGSA-N

Reference

Tyropeptins A and B, New Proteasome Inhibitors Produced by Kitasatospora sp. MK993-dF2. I. Taxonomy, Isolation, Physico-chemical Properties and Biological Activities.

PubChem CID: 11027637

LOTUS: LTS0064347

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NPAtlas: NPA007002

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Kitasatospora sp.	Kitasatospora	Streptomycetaceae	Kitasatosporales	Actinomycetes	Actinomycetota	None	Bacteria

Properties Information

Molecule Weight: 511.6190000000003

TPSA？: 155.3

MolLogP？: 4.903400000000005

Number of H-Donors: 5

Number of H-Acceptors: 6

RingCount: 2

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi