Ketomemicin B3

AlkaPlorer ID: AK103766

Synonym: None

IUPAC Name: (2R,5S,7S)-2,5-dibenzyl-7,10-bis(diaminomethylideneamino)-4,6-dioxodecanoic acid

Structure

SMILES: N=C(N)NCCC[C@H](NC(=N)N)C(=O)[C@@H](CC1=CC=CC=C1)C(=O)C[C@@H](CC1=CC=CC=C1)C(=O)O

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InChI: InChI=1S/C26H34N6O4/c27-25(28)31-13-7-12-21(32-26(29)30)23(34)20(15-18-10-5-2-6-11-18)22(33)16-19(24(35)36)14-17-8-3-1-4-9-17/h1-6,8-11,19-21H,7,12-16H2,(H,35,36)(H4,27,28,31)(H4,29,30,32)/t19-,20+,21+/m1/s1

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InChIKey: MJWKWTWOJQCUML-HKBOAZHASA-N

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Properties Information

Molecule Weight: 494.5960000000002

TPSA: 195.24

MolLogP: 1.4320400000000035

Number of H-Donors: 7

Number of H-Acceptors: 5

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information