Molecule

Laucysteinamide A

AlkaPlorer ID: AK000515

Synonym: None

IUPAC Name: (E)-N-methyl-13-[(4R)-2-methyl-4,5-dihydro-1,3-thiazol-4-yl]-N-[(1E)-penta-1,4-dienyl]tridec-12-enamide

Structure

SMILES: C=CC/C=C/N(C)C(=O)CCCCCCCCCC/C=C/[C@@H]1CSC(C)=N1

InChI: InChI=1S/C23H38N2OS/c1-4-5-16-19-25(3)23(26)18-15-13-11-9-7-6-8-10-12-14-17-22-20-27-21(2)24-22/h4,14,16-17,19,22H,1,5-13,15,18,20H2,2-3H3/b17-14+,19-16+/t22-/m1/s1

InChIKey: AYRWEQNQZDTIDT-GIWCFZTQSA-N

Reference

Laucysteinamide A, a Hybrid PKS/NRPS Metabolite from a Saipan Cyanobacterium, cf. Caldora penicillata

PubChem CID: 146683783

LOTUS: LTS0034858

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NPAtlas: NPA027467

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
None	None	None	None	Diplopoda	Arthropoda	Metazoa	Eukaryota

Properties Information

Molecule Weight: 390.637

TPSA？: 32.67

MolLogP？: 6.525600000000008

Number of H-Donors: 0

Number of H-Acceptors: 3

RingCount: 1

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Artemia salina	Artemia salina	IC50	100000.0	nM	10.1021/acs.jnatprod.0c01317
Homo sapiens	NCI-H460	IC50	20000.0	nM	10.1021/acs.jnatprod.0c01317