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

AlkaPlorer ID: AK285352

Synonym: Taurolipid A

IUPAC Name: None

Structure

SMILES: CCCCCCCCCCCCCCCC(=O)OC(CCCC(O)CCCCCC(O)CCCCC)CC(=O)NCCS(=O)(=O)O

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InChI: InChI=1S/C36H71NO8S/c1-3-5-7-8-9-10-11-12-13-14-15-16-21-28-36(41)45-34(31-35(40)37-29-30-46(42,43)44)27-22-26-33(39)25-20-17-19-24-32(38)23-18-6-4-2/h32-34,38-39H,3-31H2,1-2H3,(H,37,40)(H,42,43,44)

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InChIKey: QAZWJOOGKLJESZ-UHFFFAOYSA-N

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Reference

Source

Properties Information

Molecule Weight: 678.0300000000004

TPSA: 150.23

MolLogP: 8.196500000000007

Number of H-Donors: 4

Number of H-Acceptors: 7

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information