IC 202B

AlkaPlorer ID: AK159794

Synonym: None

IUPAC Name: N'-(5-aminopentyl)-N'-hydroxy-N-[5-[hydroxy-[4-(5-nitropentylamino)-4-oxobutanoyl]amino]pentyl]butanediamide

Structure

SMILES: NCCCCCN(O)C(=O)CCC(O)=NCCCCCN(O)C(=O)CCC(O)=NCCCCC[N+](=O)[O-]

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InChI: InChI=1S/C23H44N6O8/c24-14-4-1-7-17-27(34)22(32)12-10-20(30)25-15-5-2-8-18-28(35)23(33)13-11-21(31)26-16-6-3-9-19-29(36)37/h34-35H,1-19,24H2,(H,25,30)(H,26,31)

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InChIKey: BHNYEXHOBOECJW-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 532.6390000000005

TPSA: 215.42

MolLogP: 2.641700000000004

Number of H-Donors: 5

Number of H-Acceptors: 9

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information