2-Amino-8-tetradecene-1,3,4-triol; (2S,3S,4R,8E)-form, N-(2R-Hydroxyeicosanoyl) 

AlkaPlorer ID: AK287491

Synonym: Leucoceramide A

IUPAC Name: 2-hydroxy-N-[(E)-1,3,4-trihydroxytetradec-8-en-2-yl]icosanamide

Structure

SMILES: CCCCC/C=C/CCCC(O)C(O)C(CO)NC(=O)C(O)CCCCCCCCCCCCCCCCCC

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InChI: InChI=1S/C34H67NO5/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-22-24-26-28-32(38)34(40)35-30(29-36)33(39)31(37)27-25-23-21-12-10-8-6-4-2/h12,21,30-33,36-39H,3-11,13-20,22-29H2,1-2H3,(H,35,40)/b21-12+

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InChIKey: IFIGKVPTNWAYJW-CIAFOILYSA-N

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Reference

PubChem CID: 138176180

CAS: 903582-99-0

Source

Properties Information

Molecule Weight: 569.9120000000004

TPSA: 110.02

MolLogP: 7.504600000000008

Number of H-Donors: 5

Number of H-Acceptors: 5

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information