Chemical structure of CAS 247115-74-8

Agrochelin

CAS No.247115-74-8
MDL No.N/A
MFC23H34N2O4S2
MW466.70
InChI KeyQZBCDLLHQSDFIG-ZEVBXJOLSA-N
CUSTOM SYNTHESIS

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Product Information

Agrochelin is a thiazolidine compound with the structure (3S)-3-hydroxy-2,2-dimethyl-3-[(4R)-3-methyl-1,3-thiazolidin-4-yl]propanoic acid, substituted at position 2 by a (4R)-2-(2-hydroxy-6-pentylphenyl)-4,5-dihydro-1,3-thiazol-4-yl group. It is a cytotoxic antibiotic produced by Agrobacterium fermentation, functioning as a metabolite and antimicrobial agent. It belongs to thiazolidines, phenols, and 3-hydroxy monocarboxylic acids.

CAS No.247115-74-8
Product NameAgrochelin
Heavy Atom Count31Rotatable Bond Count9
Atom Stereo Count4Bond Stereo Count0
HBA7HBD3
TPSA93.360 ŲCharge0
Exact Mass466.19600Complexity829.79
pKa4.610XLogP3.832