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

AlkaPlorer ID: AK286885

Synonym: None

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

Structure

SMILES: CCCCCCCCC/C=C/CCCC(O)C(O)C(CO)NC(=O)CCCCCCCCCCCCCCCCCCC

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InChI: InChI=1S/C38H75NO4/c1-3-5-7-9-11-13-15-17-18-19-20-21-23-25-27-29-31-33-37(42)39-35(34-40)38(43)36(41)32-30-28-26-24-22-16-14-12-10-8-6-4-2/h24,26,35-36,38,40-41,43H,3-23,25,27-34H2,1-2H3,(H,39,42)/b26-24+

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InChIKey: ASGPYKWSAHQKOG-SHHOIMCASA-N

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Reference

PubChem CID: 14757365

CAS: 1101199-06-7

Source

Properties Information

Molecule Weight: 610.0210000000002

TPSA: 89.78999999999999

MolLogP: 10.0942

Number of H-Donors: 4

Number of H-Acceptors: 4

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information