Products 212115-96-3

CAS 212115-96-3 is the registry number for Syringolin A. Offered by: MedChemExpress. Available pack sizes: Get quote.

Structural formula: {0} (CAS {1})

Syringolin A is a syrbactin that has a (3E,9E)-2,7-dioxo-1,6-diazacyclododeca-3,9-diene skeleton that is substituted by an isopropyl group at position 5 and by a [(2S)-2-({[(1S)-1-carboxy-2-methylpropyl]carbamoyl}amino)-3-methylbutanoyl]nitrilo group at the 8-pro-S position. It is produced by the pathogenic bacterium Pseudomonas syringae pv. syringae. It has a role as a bacterial metabolite. It is a homodetic cyclic peptide, a monocarboxylic acid, a member of ureas and a syrbactin.

Source: ChEBI

Identity
Molecular formulaC24H39N5O6
Molecular weight493.6 g/mol
IUPAC name(2S)-2-[[(2S)-1-[[(3E,5S,8S,9E)-2,7-dioxo-5-propan-2-yl-1,6-diazacyclododeca-3,9-dien-8-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamoylamino]-3-methylbutanoic acid
InChIKeyRUWSLQOIGKYPEZ-YPXRAQKDSA-N
SMILESCC(C)[C@H]1/C=C/C(=O)NCC/C=C/[C@@H](C(=O)N1)NC(=O)[C@H](C(C)C)NC(=O)N[C@@H](C(C)C)C(=O)O

Computed by PubChem (NCBI)