CyanoMetDB_0660

Name: Cyanopeptolin 954

Class: Cyanopeptolin

Alternative Name:

Formula: C46H63ClN8O12

Molecular Weight: 955.504

Monoisotopic Mass (Neutral): 954.4253972

Monoisotopic Mass ([M+H]+): 955.4326734

International Chemical ID: JECPFNPTJNKMMN-LDQAUNMKSA-N

IUPAC name: (2S)-2-acetamido-N1-((2S,5S,8S,11S,12S,15S,18S,21R)-2-benzyl-5-(3-chloro-4-hydroxybenzyl)-21-hydroxy-15-isobutyl-8-isopropyl-4,11-dimethyl-3,6,9,13,16,22-hexaoxo-10-oxa-1,4,7,14,17-pentaazabicyclo[16.3.1]docosan-12-yl)pentanediamide

Chemical Structure

BuildBlock: [(Leu)--(Ahp)--(Phe)--(N-Me-Tyr-Cl)--(Val)--(O-Thr)] --GlnAc

Try one of links below to convert SMILES to structure

Chemical Structure (SMILES 1)
Chemical Structure (SMILES 2)
Chemical Structure (SMILES 3)
PubChem Link

References

Cyanopeptolin 954, a Chlorine-Containing Chymotrypsin Inhibitor of Microcystis a eruginosa NIVA Cya 43;J. Nat. Prod.;68;9;1324-1327;2005;journalArticle;10.1021/np050079r;von Elert, Eric; Oberer, Lukas; Merkel, Petra; Huhn, Thomas; Blom, Judith F.

Possible Producers

Genus: Microcystis

Species: aeruginosa