Molecule

TM 64; (S)-form, 1''-N-Ac

AlkaPlorer ID: AK290070

Synonym: Microbiaeratin

IUPAC Name: 2-(1-acetamidoethyl)-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide

Structure

SMILES: CC(O)=NC(C)C1=NC(C(O)=NCCC2=CNC3=CC=CC=C23)=CS1

InChI: InChI=1S/C18H20N4O2S/c1-11(21-12(2)23)18-22-16(10-25-18)17(24)19-8-7-13-9-20-15-6-4-3-5-14(13)15/h3-6,9-11,20H,7-8H2,1-2H3,(H,19,24)(H,21,23)

InChIKey: NNOWKGATWUOFNF-UHFFFAOYSA-N

Reference

Neobacillamide A, a Novel Thiazole‐Containing Alkaloid from the Marine Bacterium <i>Bacillus vallismortis</i> C89, Associated with South China Sea Sponge <i>Dysidea avara</i>

PubChem CID: 44820441

LOTUS: LTS0216004

COCONUT: CNP0315295.2

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NPAtlas: NPA013550

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
None	Microbispora	Streptosporangiaceae	Streptosporangiales	Actinomycetes	Actinomycetota	None	Bacteria
Thermoactinomyces sp.	Thermoactinomyces	Thermoactinomycetaceae	Bacillales	Bacilli	Bacillota	None	Bacteria

Properties Information

Molecule Weight: 356.451

TPSA？: 93.86

MolLogP？: 4.209100000000003

Number of H-Donors: 3

Number of H-Acceptors: 4

RingCount: 3

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi