Synechobactin A; N1-Deacyl, N1-decanoyl 

AlkaPlorer ID: AK067721

Synonym: Synechobactin B

IUPAC Name: 2-[2-[3-[acetyl(hydroxy)amino]propylamino]-2-oxoethyl]-4-[3-[decanoyl(hydroxy)amino]propylamino]-2-hydroxy-4-oxobutanoic acid

Structure

SMILES: CCCCCCCCCC(=O)N(O)CCCN=C(O)CC(O)(CC(O)=NCCCN(O)C(C)=O)C(=O)O

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InChI: InChI=1S/C24H44N4O9/c1-3-4-5-6-7-8-9-12-22(32)28(37)16-11-14-26-21(31)18-24(35,23(33)34)17-20(30)25-13-10-15-27(36)19(2)29/h35-37H,3-18H2,1-2H3,(H,25,30)(H,26,31)(H,33,34)

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InChIKey: DCRDXSPHBGCFJE-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 532.6350000000004

TPSA: 203.79

MolLogP: 2.8717000000000006

Number of H-Donors: 6

Number of H-Acceptors: 8

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information