81256-25-9

AlkaPlorer ID: AK076020

Synonym: None

IUPAC Name: (E,2R)-N-[N-[(E,2S)-2,4-diethylhex-4-enoyl]carbamimidoyl]-2,4-diethylhex-4-enamide

Structure

SMILES: C/C=C(\CC)C[C@@H](CC)C(O)=NC(=N)N=C(O)[C@@H](CC)C/C(=C/C)CC

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InChI: InChI=1S/C21H37N3O2/c1-7-15(8-2)13-17(11-5)19(25)23-21(22)24-20(26)18(12-6)14-16(9-3)10-4/h7,9,17-18H,8,10-14H2,1-6H3,(H3,22,23,24,25,26)/b15-7+,16-9+/t17-,18+

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InChIKey: ZSZIXCDEUHZLAH-BRRKZXQSSA-N

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Source

Properties Information

Molecule Weight: 363.5460000000002

TPSA: 89.03000000000002

MolLogP: 6.379370000000006

Number of H-Donors: 3

Number of H-Acceptors: 1

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information