tumonoic acid F

AlkaPlorer ID: AK005374

Synonym: '', 'Tumonoic acid F', '(2S)-1-(2S,3S)-3-acetyloxy-2,4-dimethyldodecanoylpyrrolidine-2-carboxylic acid'

IUPAC Name: (2S)-1-[(2S,3S,4S)-3-acetyloxy-2,4-dimethyldodecanoyl]pyrrolidine-2-carboxylic acid

Structure

SMILES: CCCCCCCC[C@H](C)[C@H](OC(C)=O)[C@H](C)C(=O)N1CCC[C@H]1C(=O)O

copy

InChI: InChI=1S/C21H37NO5/c1-5-6-7-8-9-10-12-15(2)19(27-17(4)23)16(3)20(24)22-14-11-13-18(22)21(25)26/h15-16,18-19H,5-14H2,1-4H3,(H,25,26)/t15-,16-,18-,19-/m0/s1

copy

InChIKey: PFYSYVJVRRSPAP-CAMMJAKZSA-N

copy

Source

Properties Information

Molecule Weight: 383.52900000000017

TPSA: 83.91000000000001

MolLogP: 4.016500000000002

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information