methyl tumonoate A

AlkaPlorer ID: AK008900

Synonym: None

IUPAC Name: methyl (2S)-1-[(E,2R)-3-hydroxy-2,4-dimethyldodec-4-enoyl]pyrrolidine-2-carboxylate

Structure

SMILES: CCCCCCC/C=C(\C)C(O)[C@@H](C)C(=O)N1CCC[C@H]1C(=O)OC

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InChI: InChI=1S/C20H35NO4/c1-5-6-7-8-9-10-12-15(2)18(22)16(3)19(23)21-14-11-13-17(21)20(24)25-4/h12,16-18,22H,5-11,13-14H2,1-4H3/b15-12+/t16-,17+,18?/m1/s1

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InChIKey: SZDORSKCYIOHRW-AHAKCJHSSA-N

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Source

Properties Information

Molecule Weight: 353.50300000000016

TPSA: 66.84

MolLogP: 3.454200000000002

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