2-Amino-1,3,4-eicosanetriol; (2S,3S,4R)-form, N-Hexadecanoyl 

AlkaPlorer ID: AK049949

Synonym: None

IUPAC Name: N-(1,3,4-trihydroxyicosan-2-yl)hexadecanamide

Structure

SMILES: CCCCCCCCCCCCCCCCC(O)C(O)C(CO)NC(=O)CCCCCCCCCCCCCCC

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InChI: InChI=1S/C36H73NO4/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-34(39)36(41)33(32-38)37-35(40)31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h33-34,36,38-39,41H,3-32H2,1-2H3,(H,37,40)

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InChIKey: PDRMZAIPYFJROJ-UHFFFAOYSA-N

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Reference

PubChem CID: 21776475

COCONUT: CNP0432640

Properties Information

Molecule Weight: 583.9830000000001

TPSA: 89.78999999999999

MolLogP: 9.538000000000004

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