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(S)-N-tetradecanoyl-HSL

AlkaPlorer ID: AK026645

Synonym: None

IUPAC Name: N-[(3S)-2-oxooxolan-3-yl]tetradecanamide

Structure

SMILES: CCCCCCCCCCCCCC(O)=N[C@H]1CCOC1=O

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InChI: InChI=1S/C18H33NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-17(20)19-16-14-15-22-18(16)21/h16H,2-15H2,1H3,(H,19,20)/t16-/m0/s1

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InChIKey: ZQAYHOXXVBVXPZ-INIZCTEOSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Bacillus cereus Bacillus Bacillaceae Bacillales Bacilli Bacillota None Bacteria

Properties Information

Molecule Weight: 311.46600000000007

TPSA？: 58.89000000000001

MolLogP？: 4.959500000000004

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT008817 CCCCCCCCCCCCCC(=O)N[C@H]1CCOC1=O>>CCCCCCCCCCCCCC(=O)N[C@@H](CCO)C(=O)O enzymemap_54235
AKRT008818 CCCCCCCCCCCCCC(=O)N[C@H]1CCOC1=O>>CCCCCCCCCCCCCC(=O)O enzymemap_78261
AKRT008819 CCCCCCCCCCCCCC(=O)N[C@H]1CCOC1=O>>CCCCCCCCCCCCCC(=O)O.N[C@H]1CCOC1=O None
AKRT008820 CCCCCCCCCCCCCC(=O)N[C@H]1CCOC1=O>>N[C@H]1CCOC1=O enzymemap_78261