2-Aminoethanesulfonic acid; N-(2,3,7,13-Tetrahydroxyoctadecanoyl) 

AlkaPlorer ID: AK285361

Synonym: Lysotaurolipid B

IUPAC Name: 2-(2,3,7,13-tetrahydroxyoctadecanoylamino)ethanesulfonic acid

Structure

SMILES: CCCCCC(O)CCCCCC(O)CCCC(O)C(O)C(=O)NCCS(=O)(=O)O

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InChI: InChI=1S/C20H41NO8S/c1-2-3-5-9-16(22)10-6-4-7-11-17(23)12-8-13-18(24)19(25)20(26)21-14-15-30(27,28)29/h16-19,22-25H,2-15H2,1H3,(H,21,26)(H,27,28,29)

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InChIKey: BNKDAPVTSJDIGO-UHFFFAOYSA-N

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Reference

Source

Properties Information

Molecule Weight: 455.6140000000001

TPSA: 164.39

MolLogP: 1.1351000000000009

Number of H-Donors: 6

Number of H-Acceptors: 7

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information