UNPD150263

AlkaPlorer ID: AK481369

Synonym: None

IUPAC Name: [(2S,4E,7E)-1-(3-hexyl-4-oxooxetan-2-yl)trideca-4,7-dien-2-yl] (2S)-2-formamido-4-methylpentanoate

Structure

SMILES: CCCCC/C=C/C/C=C/C[C@@H](CC1OC(=O)C1CCCCCC)OC(=O)[C@H](CC(C)C)N=CO

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InChI: InChI=1S/C29H49NO5/c1-5-7-9-11-12-13-14-15-16-18-24(34-29(33)26(30-22-31)20-23(3)4)21-27-25(28(32)35-27)19-17-10-8-6-2/h12-13,15-16,22-27H,5-11,14,17-21H2,1-4H3,(H,30,31)/b13-12+,16-15+/t24-,25?,26-,27?/m0/s1

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InChIKey: OQMAKWGYQLJJIA-OWXRFHRVSA-N

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Properties Information

Molecule Weight: 491.7130000000004

TPSA: 85.19000000000001

MolLogP: 7.274200000000007

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information