(2E)-14-[(2S,5S,6R)-5-hydroxy-6-methylpiperidin-2-yl]-2-{10-[(2S,5S,6R)-5-hydroxy-6-methylpiperidin-2-yl]decyl}tetradec-2-enal

AlkaPlorer ID: AK113949

Synonym: None

IUPAC Name: (E)-14-[(2S,5S,6R)-5-hydroxy-6-methylpiperidin-2-yl]-2-[10-[(2S,5S,6R)-5-hydroxy-6-methylpiperidin-2-yl]decyl]tetradec-2-enal

Structure

SMILES: C[C@H]1N[C@@H](CCCCCCCCCCC/C=C(/C=O)CCCCCCCCCC[C@H]2CC[C@H](O)[C@@H](C)N2)CC[C@@H]1O

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InChI: InChI=1S/C36H68N2O3/c1-30-35(40)27-25-33(37-30)23-19-15-11-6-4-3-5-9-13-17-21-32(29-39)22-18-14-10-7-8-12-16-20-24-34-26-28-36(41)31(2)38-34/h21,29-31,33-38,40-41H,3-20,22-28H2,1-2H3/b32-21+/t30-,31-,33+,34+,35+,36+/m1/s1

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InChIKey: VQQFMYFBGVBDNZ-ZLBUDNFASA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Prosopis juliflora Prosopis Fabaceae Fabales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 576.9510000000005

TPSA: 81.59

MolLogP: 8.306600000000008

Number of H-Donors: 4

Number of H-Acceptors: 5

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information