Synechobactin A

AlkaPlorer ID: AK067707

Synonym: None

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

Structure

SMILES: CCCCCCCCCCCC(=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/C26H48N4O9/c1-3-4-5-6-7-8-9-10-11-14-24(34)30(39)18-13-16-28-23(33)20-26(37,25(35)36)19-22(32)27-15-12-17-29(38)21(2)31/h37-39H,3-20H2,1-2H3,(H,27,32)(H,28,33)(H,35,36)

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InChIKey: PBPRFAHEEMSBKU-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 560.6890000000004

TPSA: 203.79

MolLogP: 3.651900000000002

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