2-Amino-4,8-eicosadiene-1,3-diol; (2S,3R,4E,8Z)-form, N-(2R-Hydroxydocosanoyl), 1-O-β-D-glucopyranoside 

AlkaPlorer ID: AK285314

Synonym: None

IUPAC Name: None

Structure

SMILES: CCCCCCCCCCC/C=C\CC/C=C/C(O)C(COC1OC(CO)C(O)C(O)C1O)NC(=O)C(O)CCCCCCCCCCCCCCCCCCCC

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InChI: InChI=1S/C48H91NO9/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-35-37-42(52)47(56)49-40(39-57-48-46(55)45(54)44(53)43(38-50)58-48)41(51)36-34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2/h26,28,34,36,40-46,48,50-55H,3-25,27,29-33,35,37-39H2,1-2H3,(H,49,56)/b28-26-,36-34+

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InChIKey: CRPQZKBTVRNJPK-SVQKYZLLSA-N

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Reference

CAS: 925701-71-9

Source

Properties Information

Molecule Weight: 826.2539999999989

TPSA: 168.94

MolLogP: 9.254800000000008

Number of H-Donors: 7

Number of H-Acceptors: 9

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information