Promysalin; 18,19-Dihydro

AlkaPlorer ID: AK311182

Synonym: Dihydropromysalin

IUPAC Name: (14-amino-13-hydroxy-14-oxotetradecan-7-yl) 1-(2-hydroxybenzoyl)pyrrolidine-2-carboxylate

Structure

SMILES: CCCCCCC(CCCCCC(O)C(=N)O)OC(=O)C1CCCN1C(=O)C1=CC=CC=C1O

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InChI: InChI=1S/C26H40N2O6/c1-2-3-4-6-12-19(13-7-5-8-17-23(30)24(27)31)34-26(33)21-15-11-18-28(21)25(32)20-14-9-10-16-22(20)29/h9-10,14,16,19,21,23,29-30H,2-8,11-13,15,17-18H2,1H3,(H2,27,31)

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InChIKey: WMHMGPUINRVYES-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 476.6140000000003

TPSA: 131.15

MolLogP: 4.7256700000000045

Number of H-Donors: 4

Number of H-Acceptors: 6

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information